dimethyl 1-[(4-fluorophenyl)methyl]-4-(3-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-[(4-fluorophenyl)methyl]-4-(3-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 1-[(4-fluorophenyl)methyl]-4-(3-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-0657 |
| Compound Name: | dimethyl 1-[(4-fluorophenyl)methyl]-4-(3-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 411.43 |
| Molecular Formula: | C23 H22 F N O5 |
| Smiles: | COC(C1=CN(Cc2ccc(cc2)F)C=C(C1c1cccc(c1)OC)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5861 |
| logD: | 3.5861 |
| logSw: | -3.6916 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.82 |
| InChI Key: | XQPTXKGEEFXDCH-UHFFFAOYSA-N |