dimethyl 1-[(4-chlorophenyl)methyl]-4-(2-fluorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-[(4-chlorophenyl)methyl]-4-(2-fluorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 1-[(4-chlorophenyl)methyl]-4-(2-fluorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-0142 |
| Compound Name: | dimethyl 1-[(4-chlorophenyl)methyl]-4-(2-fluorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 415.85 |
| Molecular Formula: | C22 H19 Cl F N O4 |
| Smiles: | COC(C1=CN(Cc2ccc(cc2)[Cl])C=C(C1c1ccccc1F)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3467 |
| logD: | 4.3467 |
| logSw: | -4.6716 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.277 |
| InChI Key: | ZLQCZWPLLMKHPE-UHFFFAOYSA-N |