propan-2-yl 4-(4-hydroxy-3-nitrophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 4-(4-hydroxy-3-nitrophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
propan-2-yl 4-(4-hydroxy-3-nitrophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 1630-0861 |
| Compound Name: | propan-2-yl 4-(4-hydroxy-3-nitrophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 386.4 |
| Molecular Formula: | C20 H22 N2 O6 |
| Smiles: | CC(C)OC(C1C(C2=C(CCCC2=O)NC=1C)c1ccc(c(c1)[N+]([O-])=O)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5222 |
| logD: | -0.3736 |
| logSw: | -3.7742 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.983 |
| InChI Key: | KZCRLAWZRAOFRH-SFHVURJKSA-N |