dimethyl 4-(3-bromo-4-methoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(3-bromo-4-methoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(3-bromo-4-methoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
Compound ID: | K837-1123 |
Compound Name: | dimethyl 4-(3-bromo-4-methoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate |
Molecular Weight: | 532.39 |
Molecular Formula: | C25 H26 Br N O7 |
Smiles: | COC(C1=CN(Cc2ccc(c(c2)OC)OC)C=C(C1c1ccc(c(c1)[Br])OC)C(=O)OC)=O |
Stereo: | ACHIRAL |
logP: | 3.5288 |
logD: | 3.5288 |
logSw: | -3.523 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 68.168 |
InChI Key: | XCAZWEACKFDFRR-UHFFFAOYSA-N |