dimethyl 1-[(4-chlorophenyl)methyl]-4-(3-ethoxy-4-hydroxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-[(4-chlorophenyl)methyl]-4-(3-ethoxy-4-hydroxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 1-[(4-chlorophenyl)methyl]-4-(3-ethoxy-4-hydroxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
Compound ID: | K837-1267 |
Compound Name: | dimethyl 1-[(4-chlorophenyl)methyl]-4-(3-ethoxy-4-hydroxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
Molecular Weight: | 457.91 |
Molecular Formula: | C24 H24 Cl N O6 |
Smiles: | CCOc1cc(ccc1O)C1C(=CN(Cc2ccc(cc2)[Cl])C=C1C(=O)OC)C(=O)OC |
Stereo: | ACHIRAL |
logP: | 3.8961 |
logD: | 3.8958 |
logSw: | -4.2619 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.035 |
InChI Key: | UDTPKMDZMAQZFD-UHFFFAOYSA-N |