1-[2-(4-chlorophenyl)-5-nitro-3-oxo-2H-1lambda~5~,2,3-triazol-4-yl]-4-methylpiperidine
Chemical Structure Depiction of
1-[2-(4-chlorophenyl)-5-nitro-3-oxo-2H-1lambda~5~,2,3-triazol-4-yl]-4-methylpiperidine
1-[2-(4-chlorophenyl)-5-nitro-3-oxo-2H-1lambda~5~,2,3-triazol-4-yl]-4-methylpiperidine
Compound characteristics
| Compound ID: | C301-0850 |
| Compound Name: | 1-[2-(4-chlorophenyl)-5-nitro-3-oxo-2H-1lambda~5~,2,3-triazol-4-yl]-4-methylpiperidine |
| Molecular Weight: | 337.76 |
| Molecular Formula: | C14 H16 Cl N5 O3 |
| Smiles: | CC1CCN(CC1)c1c(nn(c2ccc(cc2)[Cl])[n+]1[O-])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6258 |
| logD: | 3.6258 |
| logSw: | -3.8294 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 69.757 |
| InChI Key: | HZPKYOGYYMAOOI-UHFFFAOYSA-N |