dimethyl 1-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 1-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-1217 |
| Compound Name: | dimethyl 1-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 332.31 |
| Molecular Formula: | C16 H16 N2 O6 |
| Smiles: | CN1C=C(C(C(=C1)C(=O)OC)c1cccc(c1)[N+]([O-])=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.7922 |
| logD: | 1.7922 |
| logSw: | -2.0956 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.594 |
| InChI Key: | KGXXOQWQDMAGBE-UHFFFAOYSA-N |