dimethyl 4-(3-bromo-4-fluorophenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(3-bromo-4-fluorophenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(3-bromo-4-fluorophenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-1592 |
| Compound Name: | dimethyl 4-(3-bromo-4-fluorophenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 520.35 |
| Molecular Formula: | C24 H23 Br F N O6 |
| Smiles: | COC(C1=CN(Cc2ccc(c(c2)OC)OC)C=C(C1c1ccc(c(c1)[Br])F)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7503 |
| logD: | 3.7503 |
| logSw: | -4.086 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.538 |
| InChI Key: | XKSQYENGLIFFKQ-UHFFFAOYSA-N |