diethyl 1-[(3,4-dimethoxyphenyl)methyl]-4-(4-methyl-3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 1-[(3,4-dimethoxyphenyl)methyl]-4-(4-methyl-3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 1-[(3,4-dimethoxyphenyl)methyl]-4-(4-methyl-3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-0459 |
| Compound Name: | diethyl 1-[(3,4-dimethoxyphenyl)methyl]-4-(4-methyl-3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 510.54 |
| Molecular Formula: | C27 H30 N2 O8 |
| Smiles: | CCOC(C1=CN(Cc2ccc(c(c2)OC)OC)C=C(C1c1ccc(C)c(c1)[N+]([O-])=O)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3551 |
| logD: | 4.3551 |
| logSw: | -4.4537 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 92.778 |
| InChI Key: | MKTQMSYUQXAOKS-UHFFFAOYSA-N |