dimethyl 1-[(4-fluorophenyl)methyl]-4-[4-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-[(4-fluorophenyl)methyl]-4-[4-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 1-[(4-fluorophenyl)methyl]-4-[4-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K813-0076 |
| Compound Name: | dimethyl 1-[(4-fluorophenyl)methyl]-4-[4-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 449.4 |
| Molecular Formula: | C23 H19 F4 N O4 |
| Smiles: | COC(C1=CN(Cc2ccc(cc2)F)C=C(C1c1ccc(cc1)C(F)(F)F)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4464 |
| logD: | 4.4464 |
| logSw: | -4.4641 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.277 |
| InChI Key: | CVLVHBWNCFQNAI-UHFFFAOYSA-N |