dimethyl 4-(3-bromo-4-fluorophenyl)-1-(propan-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(3-bromo-4-fluorophenyl)-1-(propan-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(3-bromo-4-fluorophenyl)-1-(propan-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-1458 |
| Compound Name: | dimethyl 4-(3-bromo-4-fluorophenyl)-1-(propan-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 412.25 |
| Molecular Formula: | C18 H19 Br F N O4 |
| Smiles: | CC(C)N1C=C(C(C(=C1)C(=O)OC)c1ccc(c(c1)[Br])F)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.1899 |
| logD: | 3.1899 |
| logSw: | -3.3566 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.6 |
| InChI Key: | WOIUGBFTHBOCLE-UHFFFAOYSA-N |