dimethyl 2-(2-methoxy-2-oxoethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-(2-methoxy-2-oxoethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 2-(2-methoxy-2-oxoethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | 5991-0129 |
| Compound Name: | dimethyl 2-(2-methoxy-2-oxoethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 404.37 |
| Molecular Formula: | C19 H20 N2 O8 |
| Smiles: | CC1=C(C(C(=C(CC(=O)OC)N1)C(=O)OC)c1cccc(c1)[N+]([O-])=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2145 |
| logD: | -2.3268 |
| logSw: | -2.9033 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.269 |
| InChI Key: | NAQXGRLNPLSGNV-INIZCTEOSA-N |