dimethyl 1-[(4-methylphenyl)methyl]-4-[4-(trifluoromethoxy)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-[(4-methylphenyl)methyl]-4-[4-(trifluoromethoxy)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 1-[(4-methylphenyl)methyl]-4-[4-(trifluoromethoxy)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K813-0034 |
| Compound Name: | dimethyl 1-[(4-methylphenyl)methyl]-4-[4-(trifluoromethoxy)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 461.44 |
| Molecular Formula: | C24 H22 F3 N O5 |
| Smiles: | Cc1ccc(CN2C=C(C(C(=C2)C(=O)OC)c2ccc(cc2)OC(F)(F)F)C(=O)OC)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1592 |
| logD: | 5.1592 |
| logSw: | -5.1318 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.213 |
| InChI Key: | YAZBRIWLDMBTCF-UHFFFAOYSA-N |