propan-2-yl 4-(3-bromo-4-fluorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 4-(3-bromo-4-fluorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
propan-2-yl 4-(3-bromo-4-fluorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 8011-0996 |
| Compound Name: | propan-2-yl 4-(3-bromo-4-fluorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 370.22 |
| Molecular Formula: | C16 H17 Br F N O3 |
| Smiles: | CC(C)OC(C1C(CC(NC=1C)=O)c1ccc(c(c1)[Br])F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1526 |
| logD: | 2.2126 |
| logSw: | -3.1682 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.872 |
| InChI Key: | VPZCEGRVWZZNGJ-NSHDSACASA-N |