propyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
propyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
propyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 8009-5717 |
| Compound Name: | propyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 524.41 |
| Molecular Formula: | C27 H26 Br N O5 |
| Smiles: | CCCOC(C1C(C2=C(CC(CC2=O)c2ccccc2)NC=1C)c1cc2c(cc1[Br])OCO2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0881 |
| logD: | 1.771 |
| logSw: | -5.4946 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.813 |
| InChI Key: | ACRPOQAVPVWNMQ-UHFFFAOYSA-N |