tert-butyl 4-(3-chlorophenyl)-1-[(3,4-difluorophenyl)methyl]-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
tert-butyl 4-(3-chlorophenyl)-1-[(3,4-difluorophenyl)methyl]-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
tert-butyl 4-(3-chlorophenyl)-1-[(3,4-difluorophenyl)methyl]-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | V005-8977 |
| Compound Name: | tert-butyl 4-(3-chlorophenyl)-1-[(3,4-difluorophenyl)methyl]-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 447.91 |
| Molecular Formula: | C24 H24 Cl F2 N O3 |
| Smiles: | CC1=C(C(CC(N1Cc1ccc(c(c1)F)F)=O)c1cccc(c1)[Cl])C(=O)OC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.628 |
| logD: | 5.628 |
| logSw: | -5.9285 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.711 |
| InChI Key: | BAXQHAVERXVWNQ-SFHVURJKSA-N |