dimethyl 4-{4-[(2-bromobenzoyl)oxy]phenyl}-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-{4-[(2-bromobenzoyl)oxy]phenyl}-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-{4-[(2-bromobenzoyl)oxy]phenyl}-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | Y070-0144 |
| Compound Name: | dimethyl 4-{4-[(2-bromobenzoyl)oxy]phenyl}-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 500.35 |
| Molecular Formula: | C24 H22 Br N O6 |
| Smiles: | CC1=C(C(C(=C(C)N1)C(=O)OC)c1ccc(cc1)OC(c1ccccc1[Br])=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.1902 |
| logD: | 0.0619 |
| logSw: | -4.5473 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.08 |
| InChI Key: | QJWYBRCTXTXZKV-UHFFFAOYSA-N |