Cargando…
Theophylline–gentisic acid (1/1)
In the title 1:1 cocrystal, C(7)H(8)N(4)O(2)·C(7)H(6)O(4), the anti-asthmatic drug theophylline (systematic name: 1,3-dimethyl-7H-purine-2,6-dione) and a non-steroidal anti-inflammatory drug, gentisic acid (systematic name: 2,5-dihydroxybenzoic acid) crystallize together, forming two-dimensional hy...
Autores principales: | , , |
---|---|
Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2009
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2970150/ https://www.ncbi.nlm.nih.gov/pubmed/21577539 http://dx.doi.org/10.1107/S1600536809031031 |
_version_ | 1782190361239617536 |
---|---|
author | Aitipamula, Srinivasulu Chow, Pui Shan Tan, Reginald B. H. |
author_facet | Aitipamula, Srinivasulu Chow, Pui Shan Tan, Reginald B. H. |
author_sort | Aitipamula, Srinivasulu |
collection | PubMed |
description | In the title 1:1 cocrystal, C(7)H(8)N(4)O(2)·C(7)H(6)O(4), the anti-asthmatic drug theophylline (systematic name: 1,3-dimethyl-7H-purine-2,6-dione) and a non-steroidal anti-inflammatory drug, gentisic acid (systematic name: 2,5-dihydroxybenzoic acid) crystallize together, forming two-dimensional hydrogen-bonded sheets involving N—H⋯O and O—H⋯N hydrogen bonds. The overall crystal packing features π–π stacking interactions [centroid–centroid distance = 3.348 (1) Å]. The cocrystal described herein belongs to the class of pharmaceutical cocrystals involving two active pharmaceutical ingredients which has been relatively unexplored to date. |
format | Text |
id | pubmed-2970150 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2009 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29701502010-12-30 Theophylline–gentisic acid (1/1) Aitipamula, Srinivasulu Chow, Pui Shan Tan, Reginald B. H. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title 1:1 cocrystal, C(7)H(8)N(4)O(2)·C(7)H(6)O(4), the anti-asthmatic drug theophylline (systematic name: 1,3-dimethyl-7H-purine-2,6-dione) and a non-steroidal anti-inflammatory drug, gentisic acid (systematic name: 2,5-dihydroxybenzoic acid) crystallize together, forming two-dimensional hydrogen-bonded sheets involving N—H⋯O and O—H⋯N hydrogen bonds. The overall crystal packing features π–π stacking interactions [centroid–centroid distance = 3.348 (1) Å]. The cocrystal described herein belongs to the class of pharmaceutical cocrystals involving two active pharmaceutical ingredients which has been relatively unexplored to date. International Union of Crystallography 2009-08-08 /pmc/articles/PMC2970150/ /pubmed/21577539 http://dx.doi.org/10.1107/S1600536809031031 Text en © Aitipamula et al. 2009 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 Aitipamula, Srinivasulu Chow, Pui Shan Tan, Reginald B. H. Theophylline–gentisic acid (1/1) |
title | Theophylline–gentisic acid (1/1) |
title_full | Theophylline–gentisic acid (1/1) |
title_fullStr | Theophylline–gentisic acid (1/1) |
title_full_unstemmed | Theophylline–gentisic acid (1/1) |
title_short | Theophylline–gentisic acid (1/1) |
title_sort | theophylline–gentisic acid (1/1) |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2970150/ https://www.ncbi.nlm.nih.gov/pubmed/21577539 http://dx.doi.org/10.1107/S1600536809031031 |
work_keys_str_mv | AT aitipamulasrinivasulu theophyllinegentisicacid11 AT chowpuishan theophyllinegentisicacid11 AT tanreginaldbh theophyllinegentisicacid11 |