dimethyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-1-(2-methoxyethyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-1-(2-methoxyethyl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-1-(2-methoxyethyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | 4737-7502 |
| Compound Name: | dimethyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-1-(2-methoxyethyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 454.27 |
| Molecular Formula: | C19 H20 Br N O7 |
| Smiles: | COCCN1C=C(C(C(=C1)C(=O)OC)c1cc2c(cc1[Br])OCO2)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.4083 |
| logD: | 2.4083 |
| logSw: | -2.4911 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.985 |
| InChI Key: | RRCUAGYVVOOMRG-UHFFFAOYSA-N |