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4′-(1H-Imidazol-2-yl)-3′-[(1H-indol-3-yl)carbonyl]-1′-methyl-2-oxospiro[indoline-3,2′-pyrrolidine]-3′-carbonitrile 0.15-hydrate
In the title compound, C(25)H(20)N(6)O(2)·0.15H(2)O, the dihedral angles between the least-squares planes of the indole and pyrrolidine rings and between the oxindole and imidazole rings are 77.66 (7) and 45.31 (7)°, respectively. The pyrrolidine ring and the fused five-membered pyrrolidine ring of...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2013
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3884395/ https://www.ncbi.nlm.nih.gov/pubmed/24427102 http://dx.doi.org/10.1107/S1600536813023246 |
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author | Inglebert, S. Antony Arun, Yuvaraj Sethusankar, K. Perumal, Paramasivam T. |
author_facet | Inglebert, S. Antony Arun, Yuvaraj Sethusankar, K. Perumal, Paramasivam T. |
author_sort | Inglebert, S. Antony |
collection | PubMed |
description | In the title compound, C(25)H(20)N(6)O(2)·0.15H(2)O, the dihedral angles between the least-squares planes of the indole and pyrrolidine rings and between the oxindole and imidazole rings are 77.66 (7) and 45.31 (7)°, respectively. The pyrrolidine ring and the fused five-membered pyrrolidine ring of the oxindole moiety exhibit twisted conformations. The amide N atom is involved in both intra- and intermolecular hydrogen bonding, having a bifurcated character. The molecular structure is characterized by an intramolecular N—H⋯O hydrogen bond, which generates an S(7) ring motif while an intermolecular N—H⋯O hydrogen bond links the organic and solvent water molecules. In the crystal, N—H⋯N hydrogen bonds generate a zigzag chain running parallel to c-axis direction. The H atoms of the solvent water molecule were not located. |
format | Online Article Text |
id | pubmed-3884395 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2013 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-38843952014-01-14 4′-(1H-Imidazol-2-yl)-3′-[(1H-indol-3-yl)carbonyl]-1′-methyl-2-oxospiro[indoline-3,2′-pyrrolidine]-3′-carbonitrile 0.15-hydrate Inglebert, S. Antony Arun, Yuvaraj Sethusankar, K. Perumal, Paramasivam T. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(25)H(20)N(6)O(2)·0.15H(2)O, the dihedral angles between the least-squares planes of the indole and pyrrolidine rings and between the oxindole and imidazole rings are 77.66 (7) and 45.31 (7)°, respectively. The pyrrolidine ring and the fused five-membered pyrrolidine ring of the oxindole moiety exhibit twisted conformations. The amide N atom is involved in both intra- and intermolecular hydrogen bonding, having a bifurcated character. The molecular structure is characterized by an intramolecular N—H⋯O hydrogen bond, which generates an S(7) ring motif while an intermolecular N—H⋯O hydrogen bond links the organic and solvent water molecules. In the crystal, N—H⋯N hydrogen bonds generate a zigzag chain running parallel to c-axis direction. The H atoms of the solvent water molecule were not located. International Union of Crystallography 2013-08-31 /pmc/articles/PMC3884395/ /pubmed/24427102 http://dx.doi.org/10.1107/S1600536813023246 Text en © Inglebert et al. 2013 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 Inglebert, S. Antony Arun, Yuvaraj Sethusankar, K. Perumal, Paramasivam T. 4′-(1H-Imidazol-2-yl)-3′-[(1H-indol-3-yl)carbonyl]-1′-methyl-2-oxospiro[indoline-3,2′-pyrrolidine]-3′-carbonitrile 0.15-hydrate |
title | 4′-(1H-Imidazol-2-yl)-3′-[(1H-indol-3-yl)carbonyl]-1′-methyl-2-oxospiro[indoline-3,2′-pyrrolidine]-3′-carbonitrile 0.15-hydrate |
title_full | 4′-(1H-Imidazol-2-yl)-3′-[(1H-indol-3-yl)carbonyl]-1′-methyl-2-oxospiro[indoline-3,2′-pyrrolidine]-3′-carbonitrile 0.15-hydrate |
title_fullStr | 4′-(1H-Imidazol-2-yl)-3′-[(1H-indol-3-yl)carbonyl]-1′-methyl-2-oxospiro[indoline-3,2′-pyrrolidine]-3′-carbonitrile 0.15-hydrate |
title_full_unstemmed | 4′-(1H-Imidazol-2-yl)-3′-[(1H-indol-3-yl)carbonyl]-1′-methyl-2-oxospiro[indoline-3,2′-pyrrolidine]-3′-carbonitrile 0.15-hydrate |
title_short | 4′-(1H-Imidazol-2-yl)-3′-[(1H-indol-3-yl)carbonyl]-1′-methyl-2-oxospiro[indoline-3,2′-pyrrolidine]-3′-carbonitrile 0.15-hydrate |
title_sort | 4′-(1h-imidazol-2-yl)-3′-[(1h-indol-3-yl)carbonyl]-1′-methyl-2-oxospiro[indoline-3,2′-pyrrolidine]-3′-carbonitrile 0.15-hydrate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3884395/ https://www.ncbi.nlm.nih.gov/pubmed/24427102 http://dx.doi.org/10.1107/S1600536813023246 |
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