7-Chloro-5-cyclo­propyl-9-methyl-5H-4,5,6,10-tetra­aza­dibenzo[a,d]cyclo­hepten-11(10H)-one

In the title compound, C(15)H(13)ClN(4)O, which is a chloro derivative of the drug Nevirapine, the diazepine ring is in a twisted boat conformation. The pyridine rings fused to the diazepine fragment form a dihedral angle of 58.44 (10)° and the mol­ecule adopts a butterfly shape. The mol­ecules are...

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Autores principales: Naveen, S., Thimmegowda, N. R., Manjunath, H. R., Sridhar, M. A., Prasad, J. Shashidhara, Rangappa, K. S.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3120426/
https://www.ncbi.nlm.nih.gov/pubmed/21754822
http://dx.doi.org/10.1107/S1600536811018022
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author Naveen, S.
Thimmegowda, N. R.
Manjunath, H. R.
Sridhar, M. A.
Prasad, J. Shashidhara
Rangappa, K. S.
author_facet Naveen, S.
Thimmegowda, N. R.
Manjunath, H. R.
Sridhar, M. A.
Prasad, J. Shashidhara
Rangappa, K. S.
author_sort Naveen, S.
collection PubMed
description In the title compound, C(15)H(13)ClN(4)O, which is a chloro derivative of the drug Nevirapine, the diazepine ring is in a twisted boat conformation. The pyridine rings fused to the diazepine fragment form a dihedral angle of 58.44 (10)° and the mol­ecule adopts a butterfly shape. The mol­ecules are joined via N—H⋯N hydrogen bonding into polymeric chains down the b axis. All weaker C—H⋯O inter­actions involve the carbonyl O atom as acceptor.
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spelling pubmed-31204262011-07-13 7-Chloro-5-cyclo­propyl-9-methyl-5H-4,5,6,10-tetra­aza­dibenzo[a,d]cyclo­hepten-11(10H)-one Naveen, S. Thimmegowda, N. R. Manjunath, H. R. Sridhar, M. A. Prasad, J. Shashidhara Rangappa, K. S. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(15)H(13)ClN(4)O, which is a chloro derivative of the drug Nevirapine, the diazepine ring is in a twisted boat conformation. The pyridine rings fused to the diazepine fragment form a dihedral angle of 58.44 (10)° and the mol­ecule adopts a butterfly shape. The mol­ecules are joined via N—H⋯N hydrogen bonding into polymeric chains down the b axis. All weaker C—H⋯O inter­actions involve the carbonyl O atom as acceptor. International Union of Crystallography 2011-05-20 /pmc/articles/PMC3120426/ /pubmed/21754822 http://dx.doi.org/10.1107/S1600536811018022 Text en © Naveen et al. 2011 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Organic Papers
Naveen, S.
Thimmegowda, N. R.
Manjunath, H. R.
Sridhar, M. A.
Prasad, J. Shashidhara
Rangappa, K. S.
7-Chloro-5-cyclo­propyl-9-methyl-5H-4,5,6,10-tetra­aza­dibenzo[a,d]cyclo­hepten-11(10H)-one
title 7-Chloro-5-cyclo­propyl-9-methyl-5H-4,5,6,10-tetra­aza­dibenzo[a,d]cyclo­hepten-11(10H)-one
title_full 7-Chloro-5-cyclo­propyl-9-methyl-5H-4,5,6,10-tetra­aza­dibenzo[a,d]cyclo­hepten-11(10H)-one
title_fullStr 7-Chloro-5-cyclo­propyl-9-methyl-5H-4,5,6,10-tetra­aza­dibenzo[a,d]cyclo­hepten-11(10H)-one
title_full_unstemmed 7-Chloro-5-cyclo­propyl-9-methyl-5H-4,5,6,10-tetra­aza­dibenzo[a,d]cyclo­hepten-11(10H)-one
title_short 7-Chloro-5-cyclo­propyl-9-methyl-5H-4,5,6,10-tetra­aza­dibenzo[a,d]cyclo­hepten-11(10H)-one
title_sort 7-chloro-5-cyclo­propyl-9-methyl-5h-4,5,6,10-tetra­aza­dibenzo[a,d]cyclo­hepten-11(10h)-one
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3120426/
https://www.ncbi.nlm.nih.gov/pubmed/21754822
http://dx.doi.org/10.1107/S1600536811018022
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