propan-2-yl 1-[(4-bromophenyl)methyl]-4-(4-chlorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 1-[(4-bromophenyl)methyl]-4-(4-chlorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
propan-2-yl 1-[(4-bromophenyl)methyl]-4-(4-chlorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
Compound ID: | V023-3182 |
Compound Name: | propan-2-yl 1-[(4-bromophenyl)methyl]-4-(4-chlorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate |
Molecular Weight: | 476.8 |
Molecular Formula: | C23 H23 Br Cl N O3 |
Smiles: | CC(C)OC(C1C(CC(N(Cc2ccc(cc2)[Br])C=1C)=O)c1ccc(cc1)[Cl])=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.8196 |
logD: | 5.8196 |
logSw: | -6.1682 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 36.281 |
InChI Key: | XAEMRDAXRIZPLD-HXUWFJFHSA-N |