diethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-0650 |
| Compound Name: | diethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 546.41 |
| Molecular Formula: | C26 H28 Br N O7 |
| Smiles: | CCOC(C1=CN(Cc2ccc(cc2)OC)C=C(C1c1cc(c(c(c1)[Br])O)OC)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3816 |
| logD: | 4.374 |
| logSw: | -4.1704 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.09 |
| InChI Key: | WUGVLSQSQVKIPZ-UHFFFAOYSA-N |