8-(2-Hy­droxy­phen­yl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione

The title compound, C(13)H(12)N(4)O(3), is an imidazole derivative featuring an annealed purine ring system. The benzimidazole-inspired moiety is essentially planar (r.m.s. of all fitted non-H atoms = 0.0205 Å). An intra­molecular O—H⋯N hydrogen bond occurs. In the crystal, inter­molecular N—H⋯O and...

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Detalles Bibliográficos
Autores principales: Booysen, Irvin, Hlela, Thulani, Ismail, Muhammed, Gerber, Thomas, Hosten, Eric, Betz, Richard
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/PMC3200978/
https://www.ncbi.nlm.nih.gov/pubmed/22058964
http://dx.doi.org/10.1107/S1600536811032417
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author Booysen, Irvin
Hlela, Thulani
Ismail, Muhammed
Gerber, Thomas
Hosten, Eric
Betz, Richard
author_facet Booysen, Irvin
Hlela, Thulani
Ismail, Muhammed
Gerber, Thomas
Hosten, Eric
Betz, Richard
author_sort Booysen, Irvin
collection PubMed
description The title compound, C(13)H(12)N(4)O(3), is an imidazole derivative featuring an annealed purine ring system. The benzimidazole-inspired moiety is essentially planar (r.m.s. of all fitted non-H atoms = 0.0205 Å). An intra­molecular O—H⋯N hydrogen bond occurs. In the crystal, inter­molecular N—H⋯O and C—H⋯O hydrogen bonds are observed, which connect the mol­ecules into chains along [110]. The shortest centroid–centroid distance between two aromatic systems is 3.7771 (11) Å.
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spelling pubmed-32009782011-11-06 8-(2-Hy­droxy­phen­yl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione Booysen, Irvin Hlela, Thulani Ismail, Muhammed Gerber, Thomas Hosten, Eric Betz, Richard Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(13)H(12)N(4)O(3), is an imidazole derivative featuring an annealed purine ring system. The benzimidazole-inspired moiety is essentially planar (r.m.s. of all fitted non-H atoms = 0.0205 Å). An intra­molecular O—H⋯N hydrogen bond occurs. In the crystal, inter­molecular N—H⋯O and C—H⋯O hydrogen bonds are observed, which connect the mol­ecules into chains along [110]. The shortest centroid–centroid distance between two aromatic systems is 3.7771 (11) Å. International Union of Crystallography 2011-08-17 /pmc/articles/PMC3200978/ /pubmed/22058964 http://dx.doi.org/10.1107/S1600536811032417 Text en © Booysen 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
Booysen, Irvin
Hlela, Thulani
Ismail, Muhammed
Gerber, Thomas
Hosten, Eric
Betz, Richard
8-(2-Hy­droxy­phen­yl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
title 8-(2-Hy­droxy­phen­yl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
title_full 8-(2-Hy­droxy­phen­yl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
title_fullStr 8-(2-Hy­droxy­phen­yl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
title_full_unstemmed 8-(2-Hy­droxy­phen­yl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
title_short 8-(2-Hy­droxy­phen­yl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
title_sort 8-(2-hy­droxy­phen­yl)-1,3-dimethyl-1h-purine-2,6(3h,7h)-dione
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3200978/
https://www.ncbi.nlm.nih.gov/pubmed/22058964
http://dx.doi.org/10.1107/S1600536811032417
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