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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...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
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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. |
format | Online Article Text |
id | pubmed-3295413 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
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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