cyclohexylmethyl 4-(4-chloro-3-nitrophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
cyclohexylmethyl 4-(4-chloro-3-nitrophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
cyclohexylmethyl 4-(4-chloro-3-nitrophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | C276-1540 |
| Compound Name: | cyclohexylmethyl 4-(4-chloro-3-nitrophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 406.86 |
| Molecular Formula: | C20 H23 Cl N2 O5 |
| Smiles: | CC1=C(C(CC(N1)=O)c1ccc(c(c1)[N+]([O-])=O)[Cl])C(=O)OCC1CCCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0117 |
| logD: | 3.0717 |
| logSw: | -4.5543 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.57 |
| InChI Key: | WEXTWIDLXOUFBM-HNNXBMFYSA-N |