2-ethylbutyl 2-methyl-4-(3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
2-ethylbutyl 2-methyl-4-(3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
2-ethylbutyl 2-methyl-4-(3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | C276-1050 |
| Compound Name: | 2-ethylbutyl 2-methyl-4-(3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 360.41 |
| Molecular Formula: | C19 H24 N2 O5 |
| Smiles: | CCC(CC)COC(C1C(CC(NC=1C)=O)c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7724 |
| logD: | 2.8324 |
| logSw: | -4.273 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.95 |
| InChI Key: | RIJNVTAXAXIJPV-INIZCTEOSA-N |