Crystal Structure and Metabolic Activity of 4-(Thien-2-Yl)-2-Methyl-5-Oxo-1,4,5,6,7,8-Hexahydroquinoline-3-Carboxylic Acid Ethoxycarbonylphenyl-Methylester
Acta Crystallographica Section E: Crystallographic Communications
2018
Anatolijs Mišņovs,
E. Bisenieks,
I. Mandrika,
R. Petrovska,
Z. Kalme,
I. Bruvere,
G. Duburs
In the title compound, C25H25NO5S, which exhibits metabolism-regulating activity, the 1,4-dihydropyridine ring adopts a flattened boat conformation while the cyclohexenone ring is in an envelope conformation. Molecules in the crystal are assembled into C(6) chains along the a-axis direction via N - H⋯O hydrogen bonds. The thienyl fragment is disordered over two sets of sites in a 0.7220 (19):0.2780 (19) ratio.
Atslēgas vārdi
1,4-dihydropyridine, Crystal structure, disorder, metabolic activity
DOI
10.1107/S2056989018014251
Hipersaite
http://scripts.iucr.org/cgi-bin/paper?S2056989018014251
Mišņovs, A., Bisenieks, E., Mandrika, I., Petrovska, R., Kalme, Z., Bruvere, I., Duburs, G. Crystal Structure and Metabolic Activity of 4-(Thien-2-Yl)-2-Methyl-5-Oxo-1,4,5,6,7,8-Hexahydroquinoline-3-Carboxylic Acid Ethoxycarbonylphenyl-Methylester. Acta Crystallographica Section E: Crystallographic Communications, 2018, Vol.74, 1577.-1579.lpp. ISSN 2056-9890. Pieejams: doi:10.1107/S2056989018014251
Publikācijas valoda
English (en)