dimethyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-1184 |
| Compound Name: | dimethyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 378.34 |
| Molecular Formula: | C17 H18 N2 O8 |
| Smiles: | CN1C=C(C(C(=C1)C(=O)OC)c1cc(c(c(c1)OC)O)[N+]([O-])=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.5176 |
| logD: | 1.2217 |
| logSw: | -1.6439 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.403 |
| InChI Key: | ABSIWQHUCURGSM-UHFFFAOYSA-N |