methyl 7-(2-chlorophenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 7-(2-chlorophenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
methyl 7-(2-chlorophenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 2326-3135 |
| Compound Name: | methyl 7-(2-chlorophenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 452.89 |
| Molecular Formula: | C24 H21 Cl N2 O5 |
| Smiles: | CC1=C(C(C2=C(CC(CC2=O)c2ccccc2[Cl])N1)c1ccc(cc1)[N+]([O-])=O)C(=O)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.9781 |
| logD: | 0.4978 |
| logSw: | -5.2853 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.205 |
| InChI Key: | BIKHHFRQGNGXMW-UHFFFAOYSA-N |