ethyl 4-(4-chlorophenyl)-1-{[4-(hexylcarbamoyl)phenyl]methyl}-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-chlorophenyl)-1-{[4-(hexylcarbamoyl)phenyl]methyl}-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
ethyl 4-(4-chlorophenyl)-1-{[4-(hexylcarbamoyl)phenyl]methyl}-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | V028-0789 |
| Compound Name: | ethyl 4-(4-chlorophenyl)-1-{[4-(hexylcarbamoyl)phenyl]methyl}-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 511.06 |
| Molecular Formula: | C29 H35 Cl N2 O4 |
| Smiles: | CCCCCCNC(c1ccc(CN2C(C)=C(C(CC2=O)c2ccc(cc2)[Cl])C(=O)OCC)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7746 |
| logD: | 5.7746 |
| logSw: | -6.0208 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.128 |
| InChI Key: | WKEIQCRXQKPUOX-VWLOTQADSA-N |