diethyl 1-[(4-methoxyphenyl)methyl]-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 1-[(4-methoxyphenyl)methyl]-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 1-[(4-methoxyphenyl)methyl]-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-1456 |
| Compound Name: | diethyl 1-[(4-methoxyphenyl)methyl]-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 466.49 |
| Molecular Formula: | C25 H26 N2 O7 |
| Smiles: | CCOC(C1=CN(Cc2ccc(cc2)OC)C=C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2357 |
| logD: | 4.2357 |
| logSw: | -4.3456 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.362 |
| InChI Key: | XQMXZLURNCDYJZ-UHFFFAOYSA-N |