ethyl 1-[2-(4-chlorophenyl)-5-nitro-3-oxo-2H-1lambda~5~,2,3-triazol-4-yl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[2-(4-chlorophenyl)-5-nitro-3-oxo-2H-1lambda~5~,2,3-triazol-4-yl]piperidine-4-carboxylate
ethyl 1-[2-(4-chlorophenyl)-5-nitro-3-oxo-2H-1lambda~5~,2,3-triazol-4-yl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | C301-0590 |
| Compound Name: | ethyl 1-[2-(4-chlorophenyl)-5-nitro-3-oxo-2H-1lambda~5~,2,3-triazol-4-yl]piperidine-4-carboxylate |
| Molecular Weight: | 395.8 |
| Molecular Formula: | C16 H18 Cl N5 O5 |
| Smiles: | CCOC(C1CCN(CC1)c1c(nn(c2ccc(cc2)[Cl])[n+]1[O-])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.208 |
| logD: | 3.208 |
| logSw: | -3.4107 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 90.511 |
| InChI Key: | UOKVDQLBAGOODF-UHFFFAOYSA-N |