2-methoxyethyl 4-(2H-1,3-benzodioxol-5-yl)-7-(2-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
2-methoxyethyl 4-(2H-1,3-benzodioxol-5-yl)-7-(2-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
2-methoxyethyl 4-(2H-1,3-benzodioxol-5-yl)-7-(2-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 8013-8803 |
| Compound Name: | 2-methoxyethyl 4-(2H-1,3-benzodioxol-5-yl)-7-(2-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 495.96 |
| Molecular Formula: | C27 H26 Cl N O6 |
| Smiles: | CC1=C(C(C2=C(CC(CC2=O)c2ccccc2[Cl])N1)c1ccc2c(c1)OCO2)C(=O)OCCOC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5218 |
| logD: | 0.0415 |
| logSw: | -4.6767 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.155 |
| InChI Key: | DRABEIVYPHNGCU-UHFFFAOYSA-N |