dimethyl 4-(4-nitrophenyl)-1-[(oxolan-2-yl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(4-nitrophenyl)-1-[(oxolan-2-yl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(4-nitrophenyl)-1-[(oxolan-2-yl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | 5198-8102 |
| Compound Name: | dimethyl 4-(4-nitrophenyl)-1-[(oxolan-2-yl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 402.4 |
| Molecular Formula: | C20 H22 N2 O7 |
| Smiles: | COC(C1=CN(CC2CCCO2)C=C(C1c1ccc(cc1)[N+]([O-])=O)C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0533 |
| logD: | 2.0533 |
| logSw: | -2.3468 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.313 |
| InChI Key: | FWIURTSHBGQIJS-OAHLLOKOSA-N |