dimethyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
Compound ID: | K837-0216 |
Compound Name: | dimethyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate |
Molecular Weight: | 503.94 |
Molecular Formula: | C25 H26 Cl N O8 |
Smiles: | COC(C1=CN(Cc2ccc(c(c2)OC)OC)C=C(C1c1cc(c(c(c1)[Cl])O)OC)C(=O)OC)=O |
Stereo: | ACHIRAL |
logP: | 3.4836 |
logD: | 3.4765 |
logSw: | -3.5959 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 83.647 |
InChI Key: | OMWLDVACUMEICV-UHFFFAOYSA-N |