diethyl 4-(2H-1,3-benzodioxol-5-yl)-1-(propan-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 4-(2H-1,3-benzodioxol-5-yl)-1-(propan-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 4-(2H-1,3-benzodioxol-5-yl)-1-(propan-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-0792 |
| Compound Name: | diethyl 4-(2H-1,3-benzodioxol-5-yl)-1-(propan-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 387.43 |
| Molecular Formula: | C21 H25 N O6 |
| Smiles: | CCOC(C1=CN(C=C(C1c1ccc2c(c1)OCO2)C(=O)OCC)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3543 |
| logD: | 3.3543 |
| logSw: | -3.4499 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.875 |
| InChI Key: | QLNAJAOQQQWQGO-UHFFFAOYSA-N |