dimethyl 4-(2H-1,3-benzodioxol-5-yl)-1-[(4-methoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(2H-1,3-benzodioxol-5-yl)-1-[(4-methoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(2H-1,3-benzodioxol-5-yl)-1-[(4-methoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
Compound ID: | K813-0036 |
Compound Name: | dimethyl 4-(2H-1,3-benzodioxol-5-yl)-1-[(4-methoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate |
Molecular Weight: | 437.45 |
Molecular Formula: | C24 H23 N O7 |
Smiles: | COC(C1=CN(Cc2ccc(cc2)OC)C=C(C1c1ccc2c(c1)OCO2)C(=O)OC)=O |
Stereo: | ACHIRAL |
logP: | 3.48 |
logD: | 3.48 |
logSw: | -3.5488 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 69.936 |
InChI Key: | LAZXBDVFMDHHGA-UHFFFAOYSA-N |