2-methoxyethyl 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
2-methoxyethyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
2-methoxyethyl 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: | 2984-4836 |
| Compound Name: | 2-methoxyethyl 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: | 540.41 |
| Molecular Formula: | C27 H26 Br N O6 |
| Smiles: | CC1=C(C(C2=C(CC(CC2=O)c2ccccc2)N1)c1cc2c(cc1[Br])OCO2)C(=O)OCCOC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.6522 |
| logD: | 0.3351 |
| logSw: | -4.515 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.155 |
| InChI Key: | OOFVOYVZXSYAER-UHFFFAOYSA-N |