Synthesis and Molecular Structures of (3-Hydroxy, 3-Chloro, 3-Arylamino)-N-acetyl-3-arylaminotropones View Full Text


Ontology type: schema:ScholarlyArticle     


Article Info

DATE

2018-01

AUTHORS

V. V. Tkachev, Yu. A. Sayapin, E. A. Gusakov, A. A. Kolodina, I. V. Dorogan, G. V. Shilov, S. M. Aldoshin, V. I. Minkin

ABSTRACT

The structures of 5,7-di(tert-butyl)-2-(5,8-dimethyl-4-piperidinoquinolin-2-yl)-3-hydroxytropone, 5,7-di(tert-butyl)-3-chloro-2-(5,8-dimethyl-4-piperidinoquinolin-2-yl)tropone, 5,7-di(tert-butyl)- 3-(3,5-dimethylphenylamino)-2-(5,8-dimethyl-4-piperidinoquinolin-2-yl)tropone, and 3-(N-acetyl-3,5- dimethylphenylamino)-5,7-di(tert-butyl)-2-(5,8-dimethyl-4-piperidinoquinolin-2-yl)tropone were determined by X-ray diffraction. These compounds were synthesized through a series of transformations, including the nucleophilic substitution of the chlorine atom by piperidine in the starting 5,7-di(tert-butyl)-2-(4- chloroquinolin-2-yl)-3-hydroxytropone followed by the three-step functionalization of the 3-position in 3-hydroxytropone. The nature of dynamic processes in a solution of N-acetyl-3-arylaminotropone associated with the rotation of the N-acetyl group was revealed by the PCM/PBE0/6-31G(d,p) method. More... »

PAGES

65-73

Identifiers

URI

http://scigraph.springernature.com/pub.10.1134/s1063774518010200

DOI

http://dx.doi.org/10.1134/s1063774518010200

DIMENSIONS

https://app.dimensions.ai/details/publication/pub.1101320522


Indexing Status Check whether this publication has been indexed by Scopus and Web Of Science using the SN Indexing Status Tool
Incoming Citations Browse incoming citations for this publication using opencitations.net

JSON-LD is the canonical representation for SciGraph data.

TIP: You can open this SciGraph record using an external JSON-LD service: JSON-LD Playground Google SDTT

[
  {
    "@context": "https://springernature.github.io/scigraph/jsonld/sgcontext.json", 
    "about": [
      {
        "id": "http://purl.org/au-research/vocabulary/anzsrc-for/2008/03", 
        "inDefinedTermSet": "http://purl.org/au-research/vocabulary/anzsrc-for/2008/", 
        "name": "Chemical Sciences", 
        "type": "DefinedTerm"
      }, 
      {
        "id": "http://purl.org/au-research/vocabulary/anzsrc-for/2008/0305", 
        "inDefinedTermSet": "http://purl.org/au-research/vocabulary/anzsrc-for/2008/", 
        "name": "Organic Chemistry", 
        "type": "DefinedTerm"
      }
    ], 
    "author": [
      {
        "affiliation": {
          "alternateName": "Institute of Problems of Chemical Physics, Russian Academy of Sciences, 142432, Chernogolovka, Moscow Region, Russia", 
          "id": "http://www.grid.ac/institutes/grid.418949.9", 
          "name": [
            "Institute of Problems of Chemical Physics, Russian Academy of Sciences, 142432, Chernogolovka, Moscow Region, Russia"
          ], 
          "type": "Organization"
        }, 
        "familyName": "Tkachev", 
        "givenName": "V. V.", 
        "id": "sg:person.016125023417.42", 
        "sameAs": [
          "https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.016125023417.42"
        ], 
        "type": "Person"
      }, 
      {
        "affiliation": {
          "alternateName": "Southern Scientific Center, Russian Academy of Sciences, 344006, Rostov-on-Don, Russia", 
          "id": "http://www.grid.ac/institutes/grid.465325.3", 
          "name": [
            "Southern Scientific Center, Russian Academy of Sciences, 344006, Rostov-on-Don, Russia"
          ], 
          "type": "Organization"
        }, 
        "familyName": "Sayapin", 
        "givenName": "Yu. A.", 
        "id": "sg:person.015403724664.74", 
        "sameAs": [
          "https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.015403724664.74"
        ], 
        "type": "Person"
      }, 
      {
        "affiliation": {
          "alternateName": "Institute of Physical and Organic Chemistry, Southern Federal University, 344090, Rostov-on-Don, Russia", 
          "id": "http://www.grid.ac/institutes/grid.182798.d", 
          "name": [
            "Institute of Physical and Organic Chemistry, Southern Federal University, 344090, Rostov-on-Don, Russia"
          ], 
          "type": "Organization"
        }, 
        "familyName": "Gusakov", 
        "givenName": "E. A.", 
        "id": "sg:person.0620106643.50", 
        "sameAs": [
          "https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.0620106643.50"
        ], 
        "type": "Person"
      }, 
      {
        "affiliation": {
          "alternateName": "Institute of Physical and Organic Chemistry, Southern Federal University, 344090, Rostov-on-Don, Russia", 
          "id": "http://www.grid.ac/institutes/grid.182798.d", 
          "name": [
            "Institute of Physical and Organic Chemistry, Southern Federal University, 344090, Rostov-on-Don, Russia"
          ], 
          "type": "Organization"
        }, 
        "familyName": "Kolodina", 
        "givenName": "A. A.", 
        "id": "sg:person.01343512743.70", 
        "sameAs": [
          "https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.01343512743.70"
        ], 
        "type": "Person"
      }, 
      {
        "affiliation": {
          "alternateName": "Institute of Physical and Organic Chemistry, Southern Federal University, 344090, Rostov-on-Don, Russia", 
          "id": "http://www.grid.ac/institutes/grid.182798.d", 
          "name": [
            "Institute of Physical and Organic Chemistry, Southern Federal University, 344090, Rostov-on-Don, Russia"
          ], 
          "type": "Organization"
        }, 
        "familyName": "Dorogan", 
        "givenName": "I. V.", 
        "id": "sg:person.01030310031.06", 
        "sameAs": [
          "https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.01030310031.06"
        ], 
        "type": "Person"
      }, 
      {
        "affiliation": {
          "alternateName": "Institute of Problems of Chemical Physics, Russian Academy of Sciences, 142432, Chernogolovka, Moscow Region, Russia", 
          "id": "http://www.grid.ac/institutes/grid.418949.9", 
          "name": [
            "Institute of Problems of Chemical Physics, Russian Academy of Sciences, 142432, Chernogolovka, Moscow Region, Russia"
          ], 
          "type": "Organization"
        }, 
        "familyName": "Shilov", 
        "givenName": "G. V.", 
        "id": "sg:person.012330400613.01", 
        "sameAs": [
          "https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.012330400613.01"
        ], 
        "type": "Person"
      }, 
      {
        "affiliation": {
          "alternateName": "Institute of Problems of Chemical Physics, Russian Academy of Sciences, 142432, Chernogolovka, Moscow Region, Russia", 
          "id": "http://www.grid.ac/institutes/grid.418949.9", 
          "name": [
            "Institute of Problems of Chemical Physics, Russian Academy of Sciences, 142432, Chernogolovka, Moscow Region, Russia"
          ], 
          "type": "Organization"
        }, 
        "familyName": "Aldoshin", 
        "givenName": "S. M.", 
        "id": "sg:person.014353217357.41", 
        "sameAs": [
          "https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.014353217357.41"
        ], 
        "type": "Person"
      }, 
      {
        "affiliation": {
          "alternateName": "Institute of Physical and Organic Chemistry, Southern Federal University, 344090, Rostov-on-Don, Russia", 
          "id": "http://www.grid.ac/institutes/grid.182798.d", 
          "name": [
            "Southern Scientific Center, Russian Academy of Sciences, 344006, Rostov-on-Don, Russia", 
            "Institute of Physical and Organic Chemistry, Southern Federal University, 344090, Rostov-on-Don, Russia"
          ], 
          "type": "Organization"
        }, 
        "familyName": "Minkin", 
        "givenName": "V. I.", 
        "id": "sg:person.07535265367.87", 
        "sameAs": [
          "https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.07535265367.87"
        ], 
        "type": "Person"
      }
    ], 
    "datePublished": "2018-01", 
    "datePublishedReg": "2018-01-01", 
    "description": "The structures of 5,7-di(tert-butyl)-2-(5,8-dimethyl-4-piperidinoquinolin-2-yl)-3-hydroxytropone, 5,7-di(tert-butyl)-3-chloro-2-(5,8-dimethyl-4-piperidinoquinolin-2-yl)tropone, 5,7-di(tert-butyl)- 3-(3,5-dimethylphenylamino)-2-(5,8-dimethyl-4-piperidinoquinolin-2-yl)tropone, and 3-(N-acetyl-3,5- dimethylphenylamino)-5,7-di(tert-butyl)-2-(5,8-dimethyl-4-piperidinoquinolin-2-yl)tropone were determined by X-ray diffraction. These compounds were synthesized through a series of transformations, including the nucleophilic substitution of the chlorine atom by piperidine in the starting 5,7-di(tert-butyl)-2-(4- chloroquinolin-2-yl)-3-hydroxytropone followed by the three-step functionalization of the 3-position in 3-hydroxytropone. The nature of dynamic processes in a solution of N-acetyl-3-arylaminotropone associated with the rotation of the N-acetyl group was revealed by the PCM/PBE0/6-31G(d,p) method.", 
    "genre": "article", 
    "id": "sg:pub.10.1134/s1063774518010200", 
    "inLanguage": "en", 
    "isAccessibleForFree": false, 
    "isPartOf": [
      {
        "id": "sg:journal.1295066", 
        "issn": [
          "0023-4761", 
          "0038-5638"
        ], 
        "name": "Crystallography Reports", 
        "publisher": "Pleiades Publishing", 
        "type": "Periodical"
      }, 
      {
        "issueNumber": "1", 
        "type": "PublicationIssue"
      }, 
      {
        "type": "PublicationVolume", 
        "volumeNumber": "63"
      }
    ], 
    "keywords": [
      "molecular structure", 
      "ray diffraction", 
      "nucleophilic substitution", 
      "chlorine atoms", 
      "acetyl group", 
      "functionalization", 
      "PBE0/6", 
      "diffraction", 
      "piperidine", 
      "butyl", 
      "synthesis", 
      "compounds", 
      "atoms", 
      "structure", 
      "series of transformations", 
      "solution", 
      "substitution", 
      "dynamic process", 
      "series", 
      "nature", 
      "transformation", 
      "process", 
      "method", 
      "group", 
      "rotation", 
      "three-step functionalization", 
      "acetyl-3-arylaminotropone", 
      "PCM/PBE0/6"
    ], 
    "name": "Synthesis and Molecular Structures of (3-Hydroxy, 3-Chloro, 3-Arylamino)-N-acetyl-3-arylaminotropones", 
    "pagination": "65-73", 
    "productId": [
      {
        "name": "dimensions_id", 
        "type": "PropertyValue", 
        "value": [
          "pub.1101320522"
        ]
      }, 
      {
        "name": "doi", 
        "type": "PropertyValue", 
        "value": [
          "10.1134/s1063774518010200"
        ]
      }
    ], 
    "sameAs": [
      "https://doi.org/10.1134/s1063774518010200", 
      "https://app.dimensions.ai/details/publication/pub.1101320522"
    ], 
    "sdDataset": "articles", 
    "sdDatePublished": "2021-12-01T19:39", 
    "sdLicense": "https://scigraph.springernature.com/explorer/license/", 
    "sdPublisher": {
      "name": "Springer Nature - SN SciGraph project", 
      "type": "Organization"
    }, 
    "sdSource": "s3://com-springernature-scigraph/baseset/20211201/entities/gbq_results/article/article_757.jsonl", 
    "type": "ScholarlyArticle", 
    "url": "https://doi.org/10.1134/s1063774518010200"
  }
]
 

Download the RDF metadata as:  json-ld nt turtle xml License info

HOW TO GET THIS DATA PROGRAMMATICALLY:

JSON-LD is a popular format for linked data which is fully compatible with JSON.

curl -H 'Accept: application/ld+json' 'https://scigraph.springernature.com/pub.10.1134/s1063774518010200'

N-Triples is a line-based linked data format ideal for batch operations.

curl -H 'Accept: application/n-triples' 'https://scigraph.springernature.com/pub.10.1134/s1063774518010200'

Turtle is a human-readable linked data format.

curl -H 'Accept: text/turtle' 'https://scigraph.springernature.com/pub.10.1134/s1063774518010200'

RDF/XML is a standard XML format for linked data.

curl -H 'Accept: application/rdf+xml' 'https://scigraph.springernature.com/pub.10.1134/s1063774518010200'


 

This table displays all metadata directly associated to this object as RDF triples.

142 TRIPLES      21 PREDICATES      54 URIs      46 LITERALS      6 BLANK NODES

Subject Predicate Object
1 sg:pub.10.1134/s1063774518010200 schema:about anzsrc-for:03
2 anzsrc-for:0305
3 schema:author N624b3d376b4045b8ba731019aab60577
4 schema:datePublished 2018-01
5 schema:datePublishedReg 2018-01-01
6 schema:description The structures of 5,7-di(tert-butyl)-2-(5,8-dimethyl-4-piperidinoquinolin-2-yl)-3-hydroxytropone, 5,7-di(tert-butyl)-3-chloro-2-(5,8-dimethyl-4-piperidinoquinolin-2-yl)tropone, 5,7-di(tert-butyl)- 3-(3,5-dimethylphenylamino)-2-(5,8-dimethyl-4-piperidinoquinolin-2-yl)tropone, and 3-(N-acetyl-3,5- dimethylphenylamino)-5,7-di(tert-butyl)-2-(5,8-dimethyl-4-piperidinoquinolin-2-yl)tropone were determined by X-ray diffraction. These compounds were synthesized through a series of transformations, including the nucleophilic substitution of the chlorine atom by piperidine in the starting 5,7-di(tert-butyl)-2-(4- chloroquinolin-2-yl)-3-hydroxytropone followed by the three-step functionalization of the 3-position in 3-hydroxytropone. The nature of dynamic processes in a solution of N-acetyl-3-arylaminotropone associated with the rotation of the N-acetyl group was revealed by the PCM/PBE0/6-31G(d,p) method.
7 schema:genre article
8 schema:inLanguage en
9 schema:isAccessibleForFree false
10 schema:isPartOf N5637d35ebd26457192322110d763791d
11 Nf86ac20066a1441ab182c196f10875e2
12 sg:journal.1295066
13 schema:keywords PBE0/6
14 PCM/PBE0/6
15 acetyl group
16 acetyl-3-arylaminotropone
17 atoms
18 butyl
19 chlorine atoms
20 compounds
21 diffraction
22 dynamic process
23 functionalization
24 group
25 method
26 molecular structure
27 nature
28 nucleophilic substitution
29 piperidine
30 process
31 ray diffraction
32 rotation
33 series
34 series of transformations
35 solution
36 structure
37 substitution
38 synthesis
39 three-step functionalization
40 transformation
41 schema:name Synthesis and Molecular Structures of (3-Hydroxy, 3-Chloro, 3-Arylamino)-N-acetyl-3-arylaminotropones
42 schema:pagination 65-73
43 schema:productId N666e6b6a2b814fb6b22c8a6c6da9ca46
44 N73cead80dd744c4fb9038189a8607864
45 schema:sameAs https://app.dimensions.ai/details/publication/pub.1101320522
46 https://doi.org/10.1134/s1063774518010200
47 schema:sdDatePublished 2021-12-01T19:39
48 schema:sdLicense https://scigraph.springernature.com/explorer/license/
49 schema:sdPublisher Nf1673d14864c4d21baffc06121d01c15
50 schema:url https://doi.org/10.1134/s1063774518010200
51 sgo:license sg:explorer/license/
52 sgo:sdDataset articles
53 rdf:type schema:ScholarlyArticle
54 N03984205465a4556bf7c2e3c1081c4f2 rdf:first sg:person.012330400613.01
55 rdf:rest N33eec5be6dac48aebcffe4669875f82b
56 N29749f9155894b2c8a5ad4a574741605 rdf:first sg:person.07535265367.87
57 rdf:rest rdf:nil
58 N33eec5be6dac48aebcffe4669875f82b rdf:first sg:person.014353217357.41
59 rdf:rest N29749f9155894b2c8a5ad4a574741605
60 N5637d35ebd26457192322110d763791d schema:issueNumber 1
61 rdf:type schema:PublicationIssue
62 N624b3d376b4045b8ba731019aab60577 rdf:first sg:person.016125023417.42
63 rdf:rest N68d8f13a184944e692e872ca660d143a
64 N666e6b6a2b814fb6b22c8a6c6da9ca46 schema:name dimensions_id
65 schema:value pub.1101320522
66 rdf:type schema:PropertyValue
67 N68d8f13a184944e692e872ca660d143a rdf:first sg:person.015403724664.74
68 rdf:rest N8b98e0f653214a178dae6538e1290d01
69 N73cead80dd744c4fb9038189a8607864 schema:name doi
70 schema:value 10.1134/s1063774518010200
71 rdf:type schema:PropertyValue
72 N79a17837af3745f8942b3692f54910aa rdf:first sg:person.01030310031.06
73 rdf:rest N03984205465a4556bf7c2e3c1081c4f2
74 N8b98e0f653214a178dae6538e1290d01 rdf:first sg:person.0620106643.50
75 rdf:rest Ndd9d678324104a358847ee7f986c735f
76 Ndd9d678324104a358847ee7f986c735f rdf:first sg:person.01343512743.70
77 rdf:rest N79a17837af3745f8942b3692f54910aa
78 Nf1673d14864c4d21baffc06121d01c15 schema:name Springer Nature - SN SciGraph project
79 rdf:type schema:Organization
80 Nf86ac20066a1441ab182c196f10875e2 schema:volumeNumber 63
81 rdf:type schema:PublicationVolume
82 anzsrc-for:03 schema:inDefinedTermSet anzsrc-for:
83 schema:name Chemical Sciences
84 rdf:type schema:DefinedTerm
85 anzsrc-for:0305 schema:inDefinedTermSet anzsrc-for:
86 schema:name Organic Chemistry
87 rdf:type schema:DefinedTerm
88 sg:journal.1295066 schema:issn 0023-4761
89 0038-5638
90 schema:name Crystallography Reports
91 schema:publisher Pleiades Publishing
92 rdf:type schema:Periodical
93 sg:person.01030310031.06 schema:affiliation grid-institutes:grid.182798.d
94 schema:familyName Dorogan
95 schema:givenName I. V.
96 schema:sameAs https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.01030310031.06
97 rdf:type schema:Person
98 sg:person.012330400613.01 schema:affiliation grid-institutes:grid.418949.9
99 schema:familyName Shilov
100 schema:givenName G. V.
101 schema:sameAs https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.012330400613.01
102 rdf:type schema:Person
103 sg:person.01343512743.70 schema:affiliation grid-institutes:grid.182798.d
104 schema:familyName Kolodina
105 schema:givenName A. A.
106 schema:sameAs https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.01343512743.70
107 rdf:type schema:Person
108 sg:person.014353217357.41 schema:affiliation grid-institutes:grid.418949.9
109 schema:familyName Aldoshin
110 schema:givenName S. M.
111 schema:sameAs https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.014353217357.41
112 rdf:type schema:Person
113 sg:person.015403724664.74 schema:affiliation grid-institutes:grid.465325.3
114 schema:familyName Sayapin
115 schema:givenName Yu. A.
116 schema:sameAs https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.015403724664.74
117 rdf:type schema:Person
118 sg:person.016125023417.42 schema:affiliation grid-institutes:grid.418949.9
119 schema:familyName Tkachev
120 schema:givenName V. V.
121 schema:sameAs https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.016125023417.42
122 rdf:type schema:Person
123 sg:person.0620106643.50 schema:affiliation grid-institutes:grid.182798.d
124 schema:familyName Gusakov
125 schema:givenName E. A.
126 schema:sameAs https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.0620106643.50
127 rdf:type schema:Person
128 sg:person.07535265367.87 schema:affiliation grid-institutes:grid.182798.d
129 schema:familyName Minkin
130 schema:givenName V. I.
131 schema:sameAs https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.07535265367.87
132 rdf:type schema:Person
133 grid-institutes:grid.182798.d schema:alternateName Institute of Physical and Organic Chemistry, Southern Federal University, 344090, Rostov-on-Don, Russia
134 schema:name Institute of Physical and Organic Chemistry, Southern Federal University, 344090, Rostov-on-Don, Russia
135 Southern Scientific Center, Russian Academy of Sciences, 344006, Rostov-on-Don, Russia
136 rdf:type schema:Organization
137 grid-institutes:grid.418949.9 schema:alternateName Institute of Problems of Chemical Physics, Russian Academy of Sciences, 142432, Chernogolovka, Moscow Region, Russia
138 schema:name Institute of Problems of Chemical Physics, Russian Academy of Sciences, 142432, Chernogolovka, Moscow Region, Russia
139 rdf:type schema:Organization
140 grid-institutes:grid.465325.3 schema:alternateName Southern Scientific Center, Russian Academy of Sciences, 344006, Rostov-on-Don, Russia
141 schema:name Southern Scientific Center, Russian Academy of Sciences, 344006, Rostov-on-Don, Russia
142 rdf:type schema:Organization
 




Preview window. Press ESC to close (or click here)


...