dimethyl 1-[(4-chlorophenyl)methyl]-4-[4-(propan-2-yl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-[(4-chlorophenyl)methyl]-4-[4-(propan-2-yl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 1-[(4-chlorophenyl)methyl]-4-[4-(propan-2-yl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
Compound ID: | K837-0697 |
Compound Name: | dimethyl 1-[(4-chlorophenyl)methyl]-4-[4-(propan-2-yl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate |
Molecular Weight: | 439.94 |
Molecular Formula: | C25 H26 Cl N O4 |
Smiles: | CC(C)c1ccc(cc1)C1C(=CN(Cc2ccc(cc2)[Cl])C=C1C(=O)OC)C(=O)OC |
Stereo: | ACHIRAL |
logP: | 5.4775 |
logD: | 5.4775 |
logSw: | -6.4356 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 45.277 |
InChI Key: | BVTNZPXJNDGKCN-UHFFFAOYSA-N |