diethyl 4-{4-[(2-chlorobenzoyl)oxy]phenyl}-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 4-{4-[(2-chlorobenzoyl)oxy]phenyl}-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 4-{4-[(2-chlorobenzoyl)oxy]phenyl}-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | Y070-0198 |
| Compound Name: | diethyl 4-{4-[(2-chlorobenzoyl)oxy]phenyl}-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 483.95 |
| Molecular Formula: | C26 H26 Cl N O6 |
| Smiles: | CCOC(C1C(C(=C(C)NC=1C)C(=O)OCC)c1ccc(cc1)OC(c1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2945 |
| logD: | 1.1662 |
| logSw: | -5.9424 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.239 |
| InChI Key: | VFVGFCPANKTJQK-UHFFFAOYSA-N |