diethyl 4-(3-bromo-4-methoxyphenyl)-1-(4-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 4-(3-bromo-4-methoxyphenyl)-1-(4-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 4-(3-bromo-4-methoxyphenyl)-1-(4-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | 3671-5758 |
| Compound Name: | diethyl 4-(3-bromo-4-methoxyphenyl)-1-(4-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 500.39 |
| Molecular Formula: | C25 H26 Br N O5 |
| Smiles: | CCOC(C1=CN(C=C(C1c1ccc(c(c1)[Br])OC)C(=O)OCC)c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1982 |
| logD: | 5.1982 |
| logSw: | -5.0549 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.787 |
| InChI Key: | CITHKLTUDZVXKK-UHFFFAOYSA-N |