2-phenylethyl 2-methyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
2-phenylethyl 2-methyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
2-phenylethyl 2-methyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 2266-2579 |
| Compound Name: | 2-phenylethyl 2-methyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 432.48 |
| Molecular Formula: | C25 H24 N2 O5 |
| Smiles: | CC1=C(C(C2=C(CCCC2=O)N1)c1cccc(c1)[N+]([O-])=O)C(=O)OCCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5913 |
| logD: | 0.6955 |
| logSw: | -4.5324 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.079 |
| InChI Key: | OVQXXPRLZQWAOQ-QHCPKHFHSA-N |