diethyl 4-(4-chloro-3-nitrophenyl)-1-[(4-chlorophenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 4-(4-chloro-3-nitrophenyl)-1-[(4-chlorophenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 4-(4-chloro-3-nitrophenyl)-1-[(4-chlorophenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
Compound ID: | K837-0809 |
Compound Name: | diethyl 4-(4-chloro-3-nitrophenyl)-1-[(4-chlorophenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate |
Molecular Weight: | 505.35 |
Molecular Formula: | C24 H22 Cl2 N2 O6 |
Smiles: | CCOC(C1=CN(Cc2ccc(cc2)[Cl])C=C(C1c1ccc(c(c1)[N+]([O-])=O)[Cl])C(=O)OCC)=O |
Stereo: | ACHIRAL |
logP: | 5.2438 |
logD: | 5.2438 |
logSw: | -5.9525 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 77.517 |
InChI Key: | FUSUOPYMMMZDNN-UHFFFAOYSA-N |