diethyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-1301 |
| Compound Name: | diethyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 406.39 |
| Molecular Formula: | C19 H22 N2 O8 |
| Smiles: | CCOC(C1=CN(C)C=C(C1c1cc(c(c(c1)OC)O)[N+]([O-])=O)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3617 |
| logD: | 2.0658 |
| logSw: | -2.1089 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.563 |
| InChI Key: | VIGIJDYTRIOOEA-UHFFFAOYSA-N |