propan-2-yl 4-[4-(acetyloxy)phenyl]-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 4-[4-(acetyloxy)phenyl]-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
propan-2-yl 4-[4-(acetyloxy)phenyl]-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
Compound ID: | 4568-7323 |
Compound Name: | propan-2-yl 4-[4-(acetyloxy)phenyl]-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
Molecular Weight: | 465.57 |
Molecular Formula: | C26 H27 N O5 S |
Smiles: | CC(C)OC(C1C(C2=C(CC(CC2=O)c2cccs2)NC=1C)c1ccc(cc1)OC(C)=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.4875 |
logD: | 0.1417 |
logSw: | -4.3352 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.852 |
InChI Key: | CQURKJWCVYWRSY-UHFFFAOYSA-N |