diethyl 2,6-dimethyl-4-{4-[(2-methylbenzoyl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 2,6-dimethyl-4-{4-[(2-methylbenzoyl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 2,6-dimethyl-4-{4-[(2-methylbenzoyl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | Y070-0205 |
| Compound Name: | diethyl 2,6-dimethyl-4-{4-[(2-methylbenzoyl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 463.53 |
| Molecular Formula: | C27 H29 N O6 |
| Smiles: | CCOC(C1C(C(=C(C)NC=1C)C(=O)OCC)c1ccc(cc1)OC(c1ccccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0718 |
| logD: | 0.9434 |
| logSw: | -4.7323 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.239 |
| InChI Key: | HCBSNTKSJSQGHV-UHFFFAOYSA-N |