diethyl 1-[(4-chlorophenyl)methyl]-4-{2-[(propan-2-yl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 1-[(4-chlorophenyl)methyl]-4-{2-[(propan-2-yl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 1-[(4-chlorophenyl)methyl]-4-{2-[(propan-2-yl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
Compound ID: | K837-1110 |
Compound Name: | diethyl 1-[(4-chlorophenyl)methyl]-4-{2-[(propan-2-yl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate |
Molecular Weight: | 483.99 |
Molecular Formula: | C27 H30 Cl N O5 |
Smiles: | CCOC(C1=CN(Cc2ccc(cc2)[Cl])C=C(C1c1ccccc1OC(C)C)C(=O)OCC)=O |
Stereo: | ACHIRAL |
logP: | 5.659 |
logD: | 5.659 |
logSw: | -5.889 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 51.326 |
InChI Key: | LXZKBQJJVBDLQW-UHFFFAOYSA-N |