methyl 2-methyl-4-(4-methyl-3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
methyl 2-methyl-4-(4-methyl-3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
methyl 2-methyl-4-(4-methyl-3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 5991-0128 |
| Compound Name: | methyl 2-methyl-4-(4-methyl-3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 304.3 |
| Molecular Formula: | C15 H16 N2 O5 |
| Smiles: | CC1=C(C(CC(N1)=O)c1ccc(C)c(c1)[N+]([O-])=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0274 |
| logD: | 1.0874 |
| logSw: | -2.6992 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.694 |
| InChI Key: | KFMZVNMQKWRVHI-NSHDSACASA-N |