N-(4-Acetyl-3-methyl-1-phenyl-1H-pyrazol-5-yl)-N-methyl-2-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)benzamide

In the title compound, C(29)H(25)N(5)O(3), the dihedral angle between the benzene ring and the pendant quinazoline ring system (r.m.s. deviation = 0.036Å) is 87.60 (17)°. The equivalent angle between the pyrazole ring and the phenyl group is 70.0 (2)°. The dihedral angle between the benzene and pyra...

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Detalles Bibliográficos
Autores principales: Meneghetti, Fiorella, Maggio, Benedetta
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3790439/
https://www.ncbi.nlm.nih.gov/pubmed/24098258
http://dx.doi.org/10.1107/S1600536813025683
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author Meneghetti, Fiorella
Maggio, Benedetta
author_facet Meneghetti, Fiorella
Maggio, Benedetta
author_sort Meneghetti, Fiorella
collection PubMed
description In the title compound, C(29)H(25)N(5)O(3), the dihedral angle between the benzene ring and the pendant quinazoline ring system (r.m.s. deviation = 0.036Å) is 87.60 (17)°. The equivalent angle between the pyrazole ring and the phenyl group is 70.0 (2)°. The dihedral angle between the benzene and pyrazole rings is 30.7 (2)° and overall, the mol­ecular conformation approximates to a Z shape. A short intra­molecular C—H⋯O contact occurs. In the crystal, the mol­ecules are linked by Cπ—H⋯O-type hydrogen bonds and aromatic π–π stacking inter­actions [centroid–centroid distance = 3.860 (3) Å], generating a three-dimensional network.
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spelling pubmed-37904392013-10-04 N-(4-Acetyl-3-methyl-1-phenyl-1H-pyrazol-5-yl)-N-methyl-2-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)benzamide Meneghetti, Fiorella Maggio, Benedetta Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(29)H(25)N(5)O(3), the dihedral angle between the benzene ring and the pendant quinazoline ring system (r.m.s. deviation = 0.036Å) is 87.60 (17)°. The equivalent angle between the pyrazole ring and the phenyl group is 70.0 (2)°. The dihedral angle between the benzene and pyrazole rings is 30.7 (2)° and overall, the mol­ecular conformation approximates to a Z shape. A short intra­molecular C—H⋯O contact occurs. In the crystal, the mol­ecules are linked by Cπ—H⋯O-type hydrogen bonds and aromatic π–π stacking inter­actions [centroid–centroid distance = 3.860 (3) Å], generating a three-dimensional network. International Union of Crystallography 2013-09-25 /pmc/articles/PMC3790439/ /pubmed/24098258 http://dx.doi.org/10.1107/S1600536813025683 Text en © Meneghetti and Maggio 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
Meneghetti, Fiorella
Maggio, Benedetta
N-(4-Acetyl-3-methyl-1-phenyl-1H-pyrazol-5-yl)-N-methyl-2-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)benzamide
title N-(4-Acetyl-3-methyl-1-phenyl-1H-pyrazol-5-yl)-N-methyl-2-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)benzamide
title_full N-(4-Acetyl-3-methyl-1-phenyl-1H-pyrazol-5-yl)-N-methyl-2-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)benzamide
title_fullStr N-(4-Acetyl-3-methyl-1-phenyl-1H-pyrazol-5-yl)-N-methyl-2-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)benzamide
title_full_unstemmed N-(4-Acetyl-3-methyl-1-phenyl-1H-pyrazol-5-yl)-N-methyl-2-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)benzamide
title_short N-(4-Acetyl-3-methyl-1-phenyl-1H-pyrazol-5-yl)-N-methyl-2-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)benzamide
title_sort n-(4-acetyl-3-methyl-1-phenyl-1h-pyrazol-5-yl)-n-methyl-2-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)benzamide
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3790439/
https://www.ncbi.nlm.nih.gov/pubmed/24098258
http://dx.doi.org/10.1107/S1600536813025683
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AT maggiobenedetta n4acetyl3methyl1phenyl1hpyrazol5ylnmethyl22methyl4oxo34dihydroquinazolin3ylbenzamide

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