Cargando…

2-(5,6-Dihydro­benzimidazo[1,2-c]quinazolin-6-yl)-5-methyl­phenol

In the title compound, C(21)H(17)N(3)O, the imidazole ring is essentially planar, with a maximum deviation of 0.009 (1) Å. The mol­ecule is disordered over two sites corresponding to a rotation of approximately 180° with a refined occupancy ratio of 0.9180 (14):0.0820 (14). The central pyrim­idine r...

Descripción completa

Detalles Bibliográficos
Autores principales: Eltayeb, Naser Eltaher, Teoh, Siang Guan, Hemamalini, Madhukar, Fun, Hoong-Kun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3200579/
https://www.ncbi.nlm.nih.gov/pubmed/22058979
http://dx.doi.org/10.1107/S1600536811032673
_version_ 1782214702481276928
author Eltayeb, Naser Eltaher
Teoh, Siang Guan
Hemamalini, Madhukar
Fun, Hoong-Kun
author_facet Eltayeb, Naser Eltaher
Teoh, Siang Guan
Hemamalini, Madhukar
Fun, Hoong-Kun
author_sort Eltayeb, Naser Eltaher
collection PubMed
description In the title compound, C(21)H(17)N(3)O, the imidazole ring is essentially planar, with a maximum deviation of 0.009 (1) Å. The mol­ecule is disordered over two sites corresponding to a rotation of approximately 180° with a refined occupancy ratio of 0.9180 (14):0.0820 (14). The central pyrim­idine ring makes dihedral angles of 5.02 (5), 3.97 (5) and 6.28 (5)°, respectively, with the planes of the imidazole and the terminal phenyl rings for the major component; the values for the minor component are 5.8 (7), 5.0 (6) and 8.5 (6)°, respectively. Part of the observed planarity is accounted for in terms of an intra­molecular N—H⋯O hydrogen bond. In the crystal, mol­ecules of the major component are connected by O—H⋯N hydrogen bonds, forming supra­molecular chains along the c axis.
format Online
Article
Text
id pubmed-3200579
institution National Center for Biotechnology Information
language English
publishDate 2011
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-32005792011-11-06 2-(5,6-Dihydro­benzimidazo[1,2-c]quinazolin-6-yl)-5-methyl­phenol Eltayeb, Naser Eltaher Teoh, Siang Guan Hemamalini, Madhukar Fun, Hoong-Kun Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(21)H(17)N(3)O, the imidazole ring is essentially planar, with a maximum deviation of 0.009 (1) Å. The mol­ecule is disordered over two sites corresponding to a rotation of approximately 180° with a refined occupancy ratio of 0.9180 (14):0.0820 (14). The central pyrim­idine ring makes dihedral angles of 5.02 (5), 3.97 (5) and 6.28 (5)°, respectively, with the planes of the imidazole and the terminal phenyl rings for the major component; the values for the minor component are 5.8 (7), 5.0 (6) and 8.5 (6)°, respectively. Part of the observed planarity is accounted for in terms of an intra­molecular N—H⋯O hydrogen bond. In the crystal, mol­ecules of the major component are connected by O—H⋯N hydrogen bonds, forming supra­molecular chains along the c axis. International Union of Crystallography 2011-08-27 /pmc/articles/PMC3200579/ /pubmed/22058979 http://dx.doi.org/10.1107/S1600536811032673 Text en © Eltayeb 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
Eltayeb, Naser Eltaher
Teoh, Siang Guan
Hemamalini, Madhukar
Fun, Hoong-Kun
2-(5,6-Dihydro­benzimidazo[1,2-c]quinazolin-6-yl)-5-methyl­phenol
title 2-(5,6-Dihydro­benzimidazo[1,2-c]quinazolin-6-yl)-5-methyl­phenol
title_full 2-(5,6-Dihydro­benzimidazo[1,2-c]quinazolin-6-yl)-5-methyl­phenol
title_fullStr 2-(5,6-Dihydro­benzimidazo[1,2-c]quinazolin-6-yl)-5-methyl­phenol
title_full_unstemmed 2-(5,6-Dihydro­benzimidazo[1,2-c]quinazolin-6-yl)-5-methyl­phenol
title_short 2-(5,6-Dihydro­benzimidazo[1,2-c]quinazolin-6-yl)-5-methyl­phenol
title_sort 2-(5,6-dihydro­benzimidazo[1,2-c]quinazolin-6-yl)-5-methyl­phenol
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3200579/
https://www.ncbi.nlm.nih.gov/pubmed/22058979
http://dx.doi.org/10.1107/S1600536811032673
work_keys_str_mv AT eltayebnasereltaher 256dihydrobenzimidazo12cquinazolin6yl5methylphenol
AT teohsiangguan 256dihydrobenzimidazo12cquinazolin6yl5methylphenol
AT hemamalinimadhukar 256dihydrobenzimidazo12cquinazolin6yl5methylphenol
AT funhoongkun 256dihydrobenzimidazo12cquinazolin6yl5methylphenol