dimethyl 4-(4-{[3-(2-chlorophenyl)prop-2-enoyl]oxy}phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(4-{[3-(2-chlorophenyl)prop-2-enoyl]oxy}phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(4-{[3-(2-chlorophenyl)prop-2-enoyl]oxy}phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | Y070-0150 |
| Compound Name: | dimethyl 4-(4-{[3-(2-chlorophenyl)prop-2-enoyl]oxy}phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 481.93 |
| Molecular Formula: | C26 H24 Cl N O6 |
| Smiles: | CC1=C(C(C(=C(C)N1)C(=O)OC)c1ccc(cc1)OC(/C=C/c1ccccc1[Cl])=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.8189 |
| logD: | 0.6906 |
| logSw: | -5.1818 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.485 |
| InChI Key: | MKXTXPZKHIGOTB-UHFFFAOYSA-N |