In the title compound, C29H25N5O3, 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.

N-(4-acetyl-3-methyl-1-phenyl-1H-pyrazol-5-yl)-N-methyl-2-(2-methyl-4-oxoquinazolin-3(4H)-yl)benzamide / F. Meneghetti, B. Maggio. - In: ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE. - ISSN 1600-5368. - 69:10(2013), pp. o1582.1-o1582.10. [10.1107/S1600536813025683]

N-(4-acetyl-3-methyl-1-phenyl-1H-pyrazol-5-yl)-N-methyl-2-(2-methyl-4-oxoquinazolin-3(4H)-yl)benzamide

F. Meneghetti;
2013

Abstract

In the title compound, C29H25N5O3, 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.
Settore CHIM/08 - Chimica Farmaceutica
2013
Article (author)
File in questo prodotto:
File Dimensione Formato  
actaE2013.pdf

accesso aperto

Tipologia: Publisher's version/PDF
Dimensione 427.67 kB
Formato Adobe PDF
427.67 kB Adobe PDF Visualizza/Apri
Pubblicazioni consigliate

I documenti in IRIS sono protetti da copyright e tutti i diritti sono riservati, salvo diversa indicazione.

Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/2434/226639
Citazioni
  • ???jsp.display-item.citation.pmc??? ND
  • Scopus 0
  • ???jsp.display-item.citation.isi??? ND
social impact