dimethyl 1-[(4-chlorophenyl)methyl]-4-(2-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-[(4-chlorophenyl)methyl]-4-(2-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 1-[(4-chlorophenyl)methyl]-4-(2-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
Compound ID: | K837-1544 |
Compound Name: | dimethyl 1-[(4-chlorophenyl)methyl]-4-(2-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
Molecular Weight: | 427.88 |
Molecular Formula: | C23 H22 Cl N O5 |
Smiles: | COC(C1=CN(Cc2ccc(cc2)[Cl])C=C(C1c1ccccc1OC)C(=O)OC)=O |
Stereo: | ACHIRAL |
logP: | 4.2489 |
logD: | 4.2489 |
logSw: | -4.5862 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 52.907 |
InChI Key: | GNTKPBFSMAMTSE-UHFFFAOYSA-N |