methyl 7-(2-chlorophenyl)-2-methyl-4-(5-methylthiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 7-(2-chlorophenyl)-2-methyl-4-(5-methylthiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
methyl 7-(2-chlorophenyl)-2-methyl-4-(5-methylthiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 8014-0974 |
| Compound Name: | methyl 7-(2-chlorophenyl)-2-methyl-4-(5-methylthiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 427.95 |
| Molecular Formula: | C23 H22 Cl N O3 S |
| Smiles: | CC1=C(C(C2=C(CC(CC2=O)c2ccccc2[Cl])N1)c1ccc(C)s1)C(=O)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4662 |
| logD: | 0.8334 |
| logSw: | -5.8822 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.842 |
| InChI Key: | HGIGHMZGXILPRD-UHFFFAOYSA-N |