3-(2-methoxyethyl) 6-methyl 2,7-dimethyl-4-(2-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Chemical Structure Depiction of
3-(2-methoxyethyl) 6-methyl 2,7-dimethyl-4-(2-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
3-(2-methoxyethyl) 6-methyl 2,7-dimethyl-4-(2-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Compound characteristics
| Compound ID: | C142-0099 |
| Compound Name: | 3-(2-methoxyethyl) 6-methyl 2,7-dimethyl-4-(2-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate |
| Molecular Weight: | 458.47 |
| Molecular Formula: | C23 H26 N2 O8 |
| Smiles: | CC1CC2=C(C(C(=C(C)N2)C(=O)OCCOC)c2ccccc2[N+]([O-])=O)C(C1C(=O)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.2907 |
| logD: | -1.5433 |
| logSw: | -2.8618 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.465 |
| InChI Key: | JINILXIAMWRGMF-UHFFFAOYSA-N |