4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]-1-(2-methylbenzene-1-sulfonyl)piperidine
Chemical Structure Depiction of
4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]-1-(2-methylbenzene-1-sulfonyl)piperidine
4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]-1-(2-methylbenzene-1-sulfonyl)piperidine
Compound characteristics
| Compound ID: | S517-0865 |
| Compound Name: | 4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]-1-(2-methylbenzene-1-sulfonyl)piperidine |
| Molecular Weight: | 348.47 |
| Molecular Formula: | C17 H24 N4 O2 S |
| Smiles: | CCn1cnnc1CC1CCN(CC1)S(c1ccccc1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1558 |
| logD: | 2.1544 |
| logSw: | -2.3153 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.007 |
| InChI Key: | OWTWEMDXEIHLAO-UHFFFAOYSA-N |