propan-2-yl 4-(5-bromo-2-methoxyphenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 4-(5-bromo-2-methoxyphenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
propan-2-yl 4-(5-bromo-2-methoxyphenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | C276-0670 |
| Compound Name: | propan-2-yl 4-(5-bromo-2-methoxyphenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 382.25 |
| Molecular Formula: | C17 H20 Br N O4 |
| Smiles: | CC(C)OC(C1C(CC(NC=1C)=O)c1cc(ccc1OC)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4631 |
| logD: | 2.5231 |
| logSw: | -3.6445 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.502 |
| InChI Key: | OSYLYLLEBUQLTK-ZDUSSCGKSA-N |