N-[(3RS,4SR)-1-Benzyl-4-methyl­piperi­din-3-yl]-1-(4-methylphenyl­sulfonyl)-5-nitro-1H-pyrrolo­[2,3-b]pyridin-4-amine

The structure of the title compound, C(27)H(29)N(5)O(4)S, displays an intra­molecular N—H⋯O hydrogen bond. The pyrrolo­[2,3-b]pyridine core makes a dihedral angle of 85.5 (4)° with the benzyl residue and a dihedral angle of 89.4 (9)° with the tosyl ring. The nitro group is slightly twisted out of th...

Descripción completa

Detalles Bibliográficos
Autores principales: Pfaffenrot, Ellen, Schollmeyer, Dieter, Laufer, Stefan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3470359/
https://www.ncbi.nlm.nih.gov/pubmed/23125772
http://dx.doi.org/10.1107/S160053681203961X
_version_ 1782246260240023552
author Pfaffenrot, Ellen
Schollmeyer, Dieter
Laufer, Stefan
author_facet Pfaffenrot, Ellen
Schollmeyer, Dieter
Laufer, Stefan
author_sort Pfaffenrot, Ellen
collection PubMed
description The structure of the title compound, C(27)H(29)N(5)O(4)S, displays an intra­molecular N—H⋯O hydrogen bond. The pyrrolo­[2,3-b]pyridine core makes a dihedral angle of 85.5 (4)° with the benzyl residue and a dihedral angle of 89.4 (9)° with the tosyl ring. The nitro group is slightly twisted out of the plane of the planar pyrrolo­pyridine system [(—N—)C—C—N—O torsion angle = −4.61 (18)° and (—NH—)C—C—N—O = −6.46 (18)°].
format Online
Article
Text
id pubmed-3470359
institution National Center for Biotechnology Information
language English
publishDate 2012
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-34703592012-11-02 N-[(3RS,4SR)-1-Benzyl-4-methyl­piperi­din-3-yl]-1-(4-methylphenyl­sulfonyl)-5-nitro-1H-pyrrolo­[2,3-b]pyridin-4-amine Pfaffenrot, Ellen Schollmeyer, Dieter Laufer, Stefan Acta Crystallogr Sect E Struct Rep Online Organic Papers The structure of the title compound, C(27)H(29)N(5)O(4)S, displays an intra­molecular N—H⋯O hydrogen bond. The pyrrolo­[2,3-b]pyridine core makes a dihedral angle of 85.5 (4)° with the benzyl residue and a dihedral angle of 89.4 (9)° with the tosyl ring. The nitro group is slightly twisted out of the plane of the planar pyrrolo­pyridine system [(—N—)C—C—N—O torsion angle = −4.61 (18)° and (—NH—)C—C—N—O = −6.46 (18)°]. International Union of Crystallography 2012-09-26 /pmc/articles/PMC3470359/ /pubmed/23125772 http://dx.doi.org/10.1107/S160053681203961X Text en © Pfaffenrot 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
Pfaffenrot, Ellen
Schollmeyer, Dieter
Laufer, Stefan
N-[(3RS,4SR)-1-Benzyl-4-methyl­piperi­din-3-yl]-1-(4-methylphenyl­sulfonyl)-5-nitro-1H-pyrrolo­[2,3-b]pyridin-4-amine
title N-[(3RS,4SR)-1-Benzyl-4-methyl­piperi­din-3-yl]-1-(4-methylphenyl­sulfonyl)-5-nitro-1H-pyrrolo­[2,3-b]pyridin-4-amine
title_full N-[(3RS,4SR)-1-Benzyl-4-methyl­piperi­din-3-yl]-1-(4-methylphenyl­sulfonyl)-5-nitro-1H-pyrrolo­[2,3-b]pyridin-4-amine
title_fullStr N-[(3RS,4SR)-1-Benzyl-4-methyl­piperi­din-3-yl]-1-(4-methylphenyl­sulfonyl)-5-nitro-1H-pyrrolo­[2,3-b]pyridin-4-amine
title_full_unstemmed N-[(3RS,4SR)-1-Benzyl-4-methyl­piperi­din-3-yl]-1-(4-methylphenyl­sulfonyl)-5-nitro-1H-pyrrolo­[2,3-b]pyridin-4-amine
title_short N-[(3RS,4SR)-1-Benzyl-4-methyl­piperi­din-3-yl]-1-(4-methylphenyl­sulfonyl)-5-nitro-1H-pyrrolo­[2,3-b]pyridin-4-amine
title_sort n-[(3rs,4sr)-1-benzyl-4-methyl­piperi­din-3-yl]-1-(4-methylphenyl­sulfonyl)-5-nitro-1h-pyrrolo­[2,3-b]pyridin-4-amine
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3470359/
https://www.ncbi.nlm.nih.gov/pubmed/23125772
http://dx.doi.org/10.1107/S160053681203961X
work_keys_str_mv AT pfaffenrotellen n3rs4sr1benzyl4methylpiperidin3yl14methylphenylsulfonyl5nitro1hpyrrolo23bpyridin4amine
AT schollmeyerdieter n3rs4sr1benzyl4methylpiperidin3yl14methylphenylsulfonyl5nitro1hpyrrolo23bpyridin4amine
AT lauferstefan n3rs4sr1benzyl4methylpiperidin3yl14methylphenylsulfonyl5nitro1hpyrrolo23bpyridin4amine

Ejemplares similares