dimethyl 4-(2H-1,3-benzodioxol-5-yl)-1-[(oxolan-2-yl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(2H-1,3-benzodioxol-5-yl)-1-[(oxolan-2-yl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(2H-1,3-benzodioxol-5-yl)-1-[(oxolan-2-yl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | 8012-2800 |
| Compound Name: | dimethyl 4-(2H-1,3-benzodioxol-5-yl)-1-[(oxolan-2-yl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 401.41 |
| Molecular Formula: | C21 H23 N O7 |
| Smiles: | COC(C1=CN(CC2CCCO2)C=C(C1c1ccc2c(c1)OCO2)C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0806 |
| logD: | 2.0806 |
| logSw: | -2.655 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.047 |
| InChI Key: | IQVLLLNZPGPOCA-CQSZACIVSA-N |