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5,6-Dimethyl-4-(thio­phen-2-yl)-1H-pyrazolo­[3,4-b]pyridin-3-amine

In the title mol­ecule, C(12)H(12)N(4)S, the thio­phene ring is disordered over two orientations with a refined site-occupancy ratio of 0.777 (4):0.223 (4). The pyrazolo­pyridine ring system is essentially planar with an r.m.s. deviation of 0.0069 (3) Å and makes dihedral angles of 82.8 (2) and 72.6...

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Autores principales: Abdel-Aziz, Hatem A., Al-Rashood, Khalid A., Ghabbour, Hazem A., Chantrapromma, Suchada, Fun, Hoong-Kun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3295413/
https://www.ncbi.nlm.nih.gov/pubmed/22412524
http://dx.doi.org/10.1107/S1600536812004126
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author Abdel-Aziz, Hatem A.
Al-Rashood, Khalid A.
Ghabbour, Hazem A.
Chantrapromma, Suchada
Fun, Hoong-Kun
author_facet Abdel-Aziz, Hatem A.
Al-Rashood, Khalid A.
Ghabbour, Hazem A.
Chantrapromma, Suchada
Fun, Hoong-Kun
author_sort Abdel-Aziz, Hatem A.
collection PubMed
description In the title mol­ecule, C(12)H(12)N(4)S, the thio­phene ring is disordered over two orientations with a refined site-occupancy ratio of 0.777 (4):0.223 (4). The pyrazolo­pyridine ring system is essentially planar with an r.m.s. deviation of 0.0069 (3) Å and makes dihedral angles of 82.8 (2) and 72.6 (5)°, respectively, with the major and minor components of the thio­phene ring. In the crystal, mol­ecules are linked into a chain along the a axis by a pair of N—H⋯N(pyrazole) hydrogen bonds and a pair of N—H⋯N(pyridine) hydrogen bonds, both having a centrosymmetric R (2) (2)(8) graph-set motif. A C—H⋯π inter­action is also present.
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spelling pubmed-32954132012-03-12 5,6-Dimethyl-4-(thio­phen-2-yl)-1H-pyrazolo­[3,4-b]pyridin-3-amine Abdel-Aziz, Hatem A. Al-Rashood, Khalid A. Ghabbour, Hazem A. Chantrapromma, Suchada Fun, Hoong-Kun Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title mol­ecule, C(12)H(12)N(4)S, the thio­phene ring is disordered over two orientations with a refined site-occupancy ratio of 0.777 (4):0.223 (4). The pyrazolo­pyridine ring system is essentially planar with an r.m.s. deviation of 0.0069 (3) Å and makes dihedral angles of 82.8 (2) and 72.6 (5)°, respectively, with the major and minor components of the thio­phene ring. In the crystal, mol­ecules are linked into a chain along the a axis by a pair of N—H⋯N(pyrazole) hydrogen bonds and a pair of N—H⋯N(pyridine) hydrogen bonds, both having a centrosymmetric R (2) (2)(8) graph-set motif. A C—H⋯π inter­action is also present. International Union of Crystallography 2012-02-04 /pmc/articles/PMC3295413/ /pubmed/22412524 http://dx.doi.org/10.1107/S1600536812004126 Text en © Abdel-Aziz et al. 2012 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
Abdel-Aziz, Hatem A.
Al-Rashood, Khalid A.
Ghabbour, Hazem A.
Chantrapromma, Suchada
Fun, Hoong-Kun
5,6-Dimethyl-4-(thio­phen-2-yl)-1H-pyrazolo­[3,4-b]pyridin-3-amine
title 5,6-Dimethyl-4-(thio­phen-2-yl)-1H-pyrazolo­[3,4-b]pyridin-3-amine
title_full 5,6-Dimethyl-4-(thio­phen-2-yl)-1H-pyrazolo­[3,4-b]pyridin-3-amine
title_fullStr 5,6-Dimethyl-4-(thio­phen-2-yl)-1H-pyrazolo­[3,4-b]pyridin-3-amine
title_full_unstemmed 5,6-Dimethyl-4-(thio­phen-2-yl)-1H-pyrazolo­[3,4-b]pyridin-3-amine
title_short 5,6-Dimethyl-4-(thio­phen-2-yl)-1H-pyrazolo­[3,4-b]pyridin-3-amine
title_sort 5,6-dimethyl-4-(thio­phen-2-yl)-1h-pyrazolo­[3,4-b]pyridin-3-amine
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3295413/
https://www.ncbi.nlm.nih.gov/pubmed/22412524
http://dx.doi.org/10.1107/S1600536812004126
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