propyl 4-(6-chloro-2H-1,3-benzodioxol-5-yl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
propyl 4-(6-chloro-2H-1,3-benzodioxol-5-yl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
propyl 4-(6-chloro-2H-1,3-benzodioxol-5-yl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 2648-4208 |
| Compound Name: | propyl 4-(6-chloro-2H-1,3-benzodioxol-5-yl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 509.99 |
| Molecular Formula: | C28 H28 Cl N O6 |
| Smiles: | CCCOC(C1C(C2=C(CC(CC2=O)c2ccc(cc2)OC)NC=1C)c1cc2c(cc1[Cl])OCO2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0981 |
| logD: | 1.781 |
| logSw: | -6.3296 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.357 |
| InChI Key: | LWQKHZXICMJDJJ-UHFFFAOYSA-N |