propan-2-yl 4-(4-chlorophenyl)-2-methyl-1-[(3-nitrophenyl)methyl]-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 4-(4-chlorophenyl)-2-methyl-1-[(3-nitrophenyl)methyl]-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
propan-2-yl 4-(4-chlorophenyl)-2-methyl-1-[(3-nitrophenyl)methyl]-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | V005-7536 |
| Compound Name: | propan-2-yl 4-(4-chlorophenyl)-2-methyl-1-[(3-nitrophenyl)methyl]-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 442.9 |
| Molecular Formula: | C23 H23 Cl N2 O5 |
| Smiles: | CC(C)OC(C1C(CC(N(Cc2cccc(c2)[N+]([O-])=O)C=1C)=O)c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8478 |
| logD: | 4.8478 |
| logSw: | -5.1781 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.662 |
| InChI Key: | FJRKXSSNXLTHHR-FQEVSTJZSA-N |