diethyl 4-(2H-1,3-benzodioxol-5-yl)-1-[(4-chlorophenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 4-(2H-1,3-benzodioxol-5-yl)-1-[(4-chlorophenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 4-(2H-1,3-benzodioxol-5-yl)-1-[(4-chlorophenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-1068 |
| Compound Name: | diethyl 4-(2H-1,3-benzodioxol-5-yl)-1-[(4-chlorophenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 469.92 |
| Molecular Formula: | C25 H24 Cl N O6 |
| Smiles: | CCOC(C1=CN(Cc2ccc(cc2)[Cl])C=C(C1c1ccc2c(c1)OCO2)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9364 |
| logD: | 4.9364 |
| logSw: | -5.1313 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.552 |
| InChI Key: | RZMSRHBNSIOBRJ-UHFFFAOYSA-N |