dimethyl 2,6-dimethyl-4-{4-[(3-nitrobenzoyl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 2,6-dimethyl-4-{4-[(3-nitrobenzoyl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 2,6-dimethyl-4-{4-[(3-nitrobenzoyl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | Y070-0143 |
| Compound Name: | dimethyl 2,6-dimethyl-4-{4-[(3-nitrobenzoyl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 466.45 |
| Molecular Formula: | C24 H22 N2 O8 |
| Smiles: | CC1=C(C(C(=C(C)N1)C(=O)OC)c1ccc(cc1)OC(c1cccc(c1)[N+]([O-])=O)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.5051 |
| logD: | -0.6232 |
| logSw: | -3.8712 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.461 |
| InChI Key: | SFAYUUWVTXLWCG-UHFFFAOYSA-N |