ethyl 2-methyl-5-oxo-7-(thiophen-2-yl)-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
ethyl 2-methyl-5-oxo-7-(thiophen-2-yl)-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
ethyl 2-methyl-5-oxo-7-(thiophen-2-yl)-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
Compound ID: | 4323-7173 |
Compound Name: | ethyl 2-methyl-5-oxo-7-(thiophen-2-yl)-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
Molecular Weight: | 461.5 |
Molecular Formula: | C24 H22 F3 N O3 S |
Smiles: | CCOC(C1C(C2=C(CC(CC2=O)c2cccs2)NC=1C)c1ccc(cc1)C(F)(F)F)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.4356 |
logD: | 1.0898 |
logSw: | -5.4965 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 45.422 |
InChI Key: | JUISVYCQDRDJNL-UHFFFAOYSA-N |