2-methylpropyl 1-[(2,4-difluorophenyl)methyl]-2-methyl-4-(3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
2-methylpropyl 1-[(2,4-difluorophenyl)methyl]-2-methyl-4-(3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
2-methylpropyl 1-[(2,4-difluorophenyl)methyl]-2-methyl-4-(3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | V005-7585 |
| Compound Name: | 2-methylpropyl 1-[(2,4-difluorophenyl)methyl]-2-methyl-4-(3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 458.46 |
| Molecular Formula: | C24 H24 F2 N2 O5 |
| Smiles: | CC(C)COC(C1C(CC(N(Cc2ccc(cc2F)F)C=1C)=O)c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.788 |
| logD: | 4.788 |
| logSw: | -4.6598 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.359 |
| InChI Key: | MPBFEPPQOLSHDO-HXUWFJFHSA-N |