4-[2-(4-ethyl-4H-1,2,4-triazol-3-yl)piperidine-1-sulfonyl]benzonitrile
Chemical Structure Depiction of
4-[2-(4-ethyl-4H-1,2,4-triazol-3-yl)piperidine-1-sulfonyl]benzonitrile
4-[2-(4-ethyl-4H-1,2,4-triazol-3-yl)piperidine-1-sulfonyl]benzonitrile
Compound characteristics
| Compound ID: | P935-0845 |
| Compound Name: | 4-[2-(4-ethyl-4H-1,2,4-triazol-3-yl)piperidine-1-sulfonyl]benzonitrile |
| Molecular Weight: | 345.42 |
| Molecular Formula: | C16 H19 N5 O2 S |
| Smiles: | CCn1cnnc1C1CCCCN1S(c1ccc(C#N)cc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3888 |
| logD: | 1.3883 |
| logSw: | -2.3091 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.558 |
| InChI Key: | KFBOSGWGDJXWHZ-HNNXBMFYSA-N |