dimethyl 4-(3-bromo-5-ethoxy-4-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(3-bromo-5-ethoxy-4-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(3-bromo-5-ethoxy-4-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | 3607-5676 |
| Compound Name: | dimethyl 4-(3-bromo-5-ethoxy-4-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 426.26 |
| Molecular Formula: | C18 H20 Br N O6 |
| Smiles: | CCOc1cc(cc(c1OC)[Br])C1C(=CNC=C1C(=O)OC)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.0993 |
| logD: | 2.5499 |
| logSw: | -3.1456 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.382 |
| InChI Key: | NGXJZSWXTLTXAW-UHFFFAOYSA-N |