methyl 4-(3-bromo-4-fluorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
methyl 4-(3-bromo-4-fluorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
methyl 4-(3-bromo-4-fluorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 5991-0131 |
| Compound Name: | methyl 4-(3-bromo-4-fluorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 342.16 |
| Molecular Formula: | C14 H13 Br F N O3 |
| Smiles: | CC1=C(C(CC(N1)=O)c1ccc(c(c1)[Br])F)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2667 |
| logD: | 1.3267 |
| logSw: | -2.935 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.613 |
| InChI Key: | BDHZKGFMTNRTFE-VIFPVBQESA-N |