diethyl 4-(4-chloro-3-nitrophenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 4-(4-chloro-3-nitrophenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 4-(4-chloro-3-nitrophenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-0217 |
| Compound Name: | diethyl 4-(4-chloro-3-nitrophenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 530.96 |
| Molecular Formula: | C26 H27 Cl N2 O8 |
| Smiles: | CCOC(C1=CN(Cc2ccc(c(c2)OC)OC)C=C(C1c1ccc(c(c1)[N+]([O-])=O)[Cl])C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2221 |
| logD: | 4.2221 |
| logSw: | -4.7417 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 92.778 |
| InChI Key: | YRTDRYYPLFAGGP-UHFFFAOYSA-N |