dimethyl 4-(6-chloro-2H-1,3-benzodioxol-5-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(6-chloro-2H-1,3-benzodioxol-5-yl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(6-chloro-2H-1,3-benzodioxol-5-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | 8011-0634 |
| Compound Name: | dimethyl 4-(6-chloro-2H-1,3-benzodioxol-5-yl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 351.74 |
| Molecular Formula: | C16 H14 Cl N O6 |
| Smiles: | COC(C1=CNC=C(C1c1cc2c(cc1[Cl])OCO2)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7114 |
| logD: | 2.2726 |
| logSw: | -3.2844 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.571 |
| InChI Key: | HZZYPWLHFCUDFG-UHFFFAOYSA-N |