4-methyl-1-(5-nitro-3-oxo-2-phenyl-2H-1lambda~5~,2,3-triazol-4-yl)piperidine
Chemical Structure Depiction of
4-methyl-1-(5-nitro-3-oxo-2-phenyl-2H-1lambda~5~,2,3-triazol-4-yl)piperidine
4-methyl-1-(5-nitro-3-oxo-2-phenyl-2H-1lambda~5~,2,3-triazol-4-yl)piperidine
Compound characteristics
| Compound ID: | C359-0180 |
| Compound Name: | 4-methyl-1-(5-nitro-3-oxo-2-phenyl-2H-1lambda~5~,2,3-triazol-4-yl)piperidine |
| Molecular Weight: | 303.32 |
| Molecular Formula: | C14 H17 N5 O3 |
| Smiles: | CC1CCN(CC1)c1c(nn(c2ccccc2)[n+]1[O-])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9095 |
| logD: | 2.9095 |
| logSw: | -3.2629 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 69.757 |
| InChI Key: | AWTWYKUBGFPDED-UHFFFAOYSA-N |