ethyl 1-[(2,3-difluorophenyl)methyl]-2-methyl-4-(4-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[(2,3-difluorophenyl)methyl]-2-methyl-4-(4-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
ethyl 1-[(2,3-difluorophenyl)methyl]-2-methyl-4-(4-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | V010-8267 |
| Compound Name: | ethyl 1-[(2,3-difluorophenyl)methyl]-2-methyl-4-(4-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 430.41 |
| Molecular Formula: | C22 H20 F2 N2 O5 |
| Smiles: | CCOC(C1C(CC(N(Cc2cccc(c2F)F)C=1C)=O)c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2103 |
| logD: | 4.2103 |
| logSw: | -4.2186 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.983 |
| InChI Key: | HXCPRZGDUUITOS-KRWDZBQOSA-N |