diethyl 4-(4-chloro-3-nitrophenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 4-(4-chloro-3-nitrophenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 4-(4-chloro-3-nitrophenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-0381 |
| Compound Name: | diethyl 4-(4-chloro-3-nitrophenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 394.81 |
| Molecular Formula: | C18 H19 Cl N2 O6 |
| Smiles: | CCOC(C1=CN(C)C=C(C1c1ccc(c(c1)[N+]([O-])=O)[Cl])C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0321 |
| logD: | 3.0321 |
| logSw: | -3.658 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.453 |
| InChI Key: | SADOPKDBANLCGG-UHFFFAOYSA-N |