cycloheptyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
cycloheptyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
cycloheptyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 8013-8804 |
| Compound Name: | cycloheptyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 470.52 |
| Molecular Formula: | C25 H30 N2 O7 |
| Smiles: | CC1=C(C(C2=C(CCCC2=O)N1)c1cc(c(c(c1)OC)O)[N+]([O-])=O)C(=O)OC1CCCCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8624 |
| logD: | 0.9667 |
| logSw: | -4.4903 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.526 |
| InChI Key: | CSGQZSHDBKVAJJ-QFIPXVFZSA-N |