propan-2-yl 4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
propan-2-yl 4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 3192-5328 |
| Compound Name: | propan-2-yl 4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 430.46 |
| Molecular Formula: | C22 H26 N2 O7 |
| Smiles: | CCOc1cc(cc(c1O)[N+]([O-])=O)C1C(=C(C)NC2CCCC(C1=2)=O)C(=O)OC(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9599 |
| logD: | 0.0642 |
| logSw: | -3.9884 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.124 |
| InChI Key: | IKWRILOFAAQNAW-IBGZPJMESA-N |