dimethyl 1-[(4-fluorophenyl)methyl]-4-(4-hydroxy-3-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-[(4-fluorophenyl)methyl]-4-(4-hydroxy-3-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 1-[(4-fluorophenyl)methyl]-4-(4-hydroxy-3-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-0627 |
| Compound Name: | dimethyl 1-[(4-fluorophenyl)methyl]-4-(4-hydroxy-3-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 427.43 |
| Molecular Formula: | C23 H22 F N O6 |
| Smiles: | COC(C1=CN(Cc2ccc(cc2)F)C=C(C1c1ccc(c(c1)OC)O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8116 |
| logD: | 2.8112 |
| logSw: | -2.9469 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.455 |
| InChI Key: | LSJHVBZNMRTBJS-UHFFFAOYSA-N |