3-[(1-Isobutyl-1H-imidazo[4,5-c]quinolin-4-yl)amino]benzoic acid

In the title compound, C21H20N4O2, the statistically planar 1H-limidazole ring [maximum deviation = 0.003 (1) Å] makes dihedral angles of 1.33 (9) and 8.23 (7)°, respectively, with the essentially planar fused pyridine...

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Main Authors: Hoong-Kun Fun, Tara Shahani, Dinesh, Reshma Kayarmar, G. K. Nagaraja
Format: Article
Language:English
Published: International Union of Crystallography 2011-08-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536811028765
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spelling doaj-95de57b7f1bf4deca9741bf38274b4e82020-11-25T01:11:09ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682011-08-01678o2150o215010.1107/S16005368110287653-[(1-Isobutyl-1H-imidazo[4,5-c]quinolin-4-yl)amino]benzoic acidHoong-Kun FunTara ShahaniDineshReshma KayarmarG. K. NagarajaIn the title compound, C21H20N4O2, the statistically planar 1H-limidazole ring [maximum deviation = 0.003 (1) Å] makes dihedral angles of 1.33 (9) and 8.23 (7)°, respectively, with the essentially planar fused pyridine ring [maximum devation = 0.018 (1) Å] and the pendant benzene ring, which is attached to the pyridine ring by an —NH— group. An intramolecular C—H...N interaction, which generates an S(6) ring, helps to estalish the molecular conformation. In the crystal, the molecules are linked by N—H...O, C—H...O and O—H—N hydrogen bonds, which generate bifurcated R12(6) and R22(9) ring motifs, resulting in supramolecular [001] chains. The crystal structure also features weak π–π stacking [centroid–centroid distance = 3.5943 (9) Å] and C—H...π interactions.http://scripts.iucr.org/cgi-bin/paper?S1600536811028765
collection DOAJ
language English
format Article
sources DOAJ
author Hoong-Kun Fun
Tara Shahani
Dinesh
Reshma Kayarmar
G. K. Nagaraja
spellingShingle Hoong-Kun Fun
Tara Shahani
Dinesh
Reshma Kayarmar
G. K. Nagaraja
3-[(1-Isobutyl-1H-imidazo[4,5-c]quinolin-4-yl)amino]benzoic acid
Acta Crystallographica Section E
author_facet Hoong-Kun Fun
Tara Shahani
Dinesh
Reshma Kayarmar
G. K. Nagaraja
author_sort Hoong-Kun Fun
title 3-[(1-Isobutyl-1H-imidazo[4,5-c]quinolin-4-yl)amino]benzoic acid
title_short 3-[(1-Isobutyl-1H-imidazo[4,5-c]quinolin-4-yl)amino]benzoic acid
title_full 3-[(1-Isobutyl-1H-imidazo[4,5-c]quinolin-4-yl)amino]benzoic acid
title_fullStr 3-[(1-Isobutyl-1H-imidazo[4,5-c]quinolin-4-yl)amino]benzoic acid
title_full_unstemmed 3-[(1-Isobutyl-1H-imidazo[4,5-c]quinolin-4-yl)amino]benzoic acid
title_sort 3-[(1-isobutyl-1h-imidazo[4,5-c]quinolin-4-yl)amino]benzoic acid
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2011-08-01
description In the title compound, C21H20N4O2, the statistically planar 1H-limidazole ring [maximum deviation = 0.003 (1) Å] makes dihedral angles of 1.33 (9) and 8.23 (7)°, respectively, with the essentially planar fused pyridine ring [maximum devation = 0.018 (1) Å] and the pendant benzene ring, which is attached to the pyridine ring by an —NH— group. An intramolecular C—H...N interaction, which generates an S(6) ring, helps to estalish the molecular conformation. In the crystal, the molecules are linked by N—H...O, C—H...O and O—H—N hydrogen bonds, which generate bifurcated R12(6) and R22(9) ring motifs, resulting in supramolecular [001] chains. The crystal structure also features weak π–π stacking [centroid–centroid distance = 3.5943 (9) Å] and C—H...π interactions.
url http://scripts.iucr.org/cgi-bin/paper?S1600536811028765
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AT tarashahani 31isobutyl1himidazo45cquinolin4ylaminobenzoicacid
AT dinesh 31isobutyl1himidazo45cquinolin4ylaminobenzoicacid
AT reshmakayarmar 31isobutyl1himidazo45cquinolin4ylaminobenzoicacid
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