dimethyl 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-1-[(4-chlorophenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-1-[(4-chlorophenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-1-[(4-chlorophenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-1100 |
| Compound Name: | dimethyl 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-1-[(4-chlorophenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 550.83 |
| Molecular Formula: | C25 H25 Br Cl N O6 |
| Smiles: | CCOc1c(cc(cc1[Br])C1C(=CN(Cc2ccc(cc2)[Cl])C=C1C(=O)OC)C(=O)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 5.1681 |
| logD: | 5.1681 |
| logSw: | -5.6616 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.204 |
| InChI Key: | LBZPQZFUOBAFAC-UHFFFAOYSA-N |