2-[(propan-2-yl)oxy]ethyl 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-[(propan-2-yl)oxy]ethyl 4-(2H-1,3-benzodioxol-5-yl)-7-(2-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
2-[(propan-2-yl)oxy]ethyl 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: | 8014-3451 |
| Compound Name: | 2-[(propan-2-yl)oxy]ethyl 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: | 524.01 |
| Molecular Formula: | C29 H30 Cl N O6 |
| Smiles: | CC(C)OCCOC(C1C(C2=C(CC(CC2=O)c2ccccc2[Cl])NC=1C)c1ccc2c(c1)OCO2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3655 |
| logD: | 0.8852 |
| logSw: | -6.0599 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.014 |
| InChI Key: | JCZXAZXYCDVIQV-UHFFFAOYSA-N |