diethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-1460 |
| Compound Name: | diethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 576.44 |
| Molecular Formula: | C27 H30 Br N O8 |
| Smiles: | CCOC(C1=CN(Cc2ccc(c(c2)OC)OC)C=C(C1c1cc(c(c(c1)[Br])O)OC)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9722 |
| logD: | 3.9646 |
| logSw: | -3.9407 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.807 |
| InChI Key: | YNZYQMJJNBFDSY-UHFFFAOYSA-N |