dimethyl 1-[(4-chlorophenyl)methyl]-4-(2-ethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-[(4-chlorophenyl)methyl]-4-(2-ethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 1-[(4-chlorophenyl)methyl]-4-(2-ethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
Compound ID: | K837-1112 |
Compound Name: | dimethyl 1-[(4-chlorophenyl)methyl]-4-(2-ethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
Molecular Weight: | 441.91 |
Molecular Formula: | C24 H24 Cl N O5 |
Smiles: | CCOc1ccccc1C1C(=CN(Cc2ccc(cc2)[Cl])C=C1C(=O)OC)C(=O)OC |
Stereo: | ACHIRAL |
logP: | 4.6598 |
logD: | 4.6598 |
logSw: | -4.7918 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 52.487 |
InChI Key: | ZIGHRRWCSGSFLZ-UHFFFAOYSA-N |