diethyl 2,6-dimethyl-4-{4-[(3-nitrobenzoyl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 2,6-dimethyl-4-{4-[(3-nitrobenzoyl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 2,6-dimethyl-4-{4-[(3-nitrobenzoyl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | Y070-0203 |
| Compound Name: | diethyl 2,6-dimethyl-4-{4-[(3-nitrobenzoyl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 494.5 |
| Molecular Formula: | C26 H26 N2 O8 |
| Smiles: | CCOC(C1C(C(=C(C)NC=1C)C(=O)OCC)c1ccc(cc1)OC(c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3862 |
| logD: | 0.2579 |
| logSw: | -4.4157 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.621 |
| InChI Key: | HUVFMLBPFHWBGC-UHFFFAOYSA-N |