dimethyl 4-(3-bromo-4-methoxyphenyl)-1-[(4-fluorophenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(3-bromo-4-methoxyphenyl)-1-[(4-fluorophenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(3-bromo-4-methoxyphenyl)-1-[(4-fluorophenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-0636 |
| Compound Name: | dimethyl 4-(3-bromo-4-methoxyphenyl)-1-[(4-fluorophenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 490.32 |
| Molecular Formula: | C23 H21 Br F N O5 |
| Smiles: | COC(C1=CN(Cc2ccc(cc2)F)C=C(C1c1ccc(c(c1)[Br])OC)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9848 |
| logD: | 3.9848 |
| logSw: | -4.2155 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.907 |
| InChI Key: | PWGMSIDIQTXDRO-UHFFFAOYSA-N |