diethyl 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-0260 |
| Compound Name: | diethyl 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 468.34 |
| Molecular Formula: | C21 H26 Br N O6 |
| Smiles: | CCOC(C1=CN(C)C=C(C1c1cc(c(c(c1)[Br])OCC)OC)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8005 |
| logD: | 3.8005 |
| logSw: | -3.904 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.3 |
| InChI Key: | FBKIPJLWVIZHGV-UHFFFAOYSA-N |