4-[3-(propan-2-yl)-4H-1,2,4-triazol-4-yl]-1-[4-(trifluoromethyl)benzene-1-sulfonyl]piperidine
Chemical Structure Depiction of
4-[3-(propan-2-yl)-4H-1,2,4-triazol-4-yl]-1-[4-(trifluoromethyl)benzene-1-sulfonyl]piperidine
4-[3-(propan-2-yl)-4H-1,2,4-triazol-4-yl]-1-[4-(trifluoromethyl)benzene-1-sulfonyl]piperidine
Compound characteristics
| Compound ID: | P939-5490 |
| Compound Name: | 4-[3-(propan-2-yl)-4H-1,2,4-triazol-4-yl]-1-[4-(trifluoromethyl)benzene-1-sulfonyl]piperidine |
| Molecular Weight: | 402.44 |
| Molecular Formula: | C17 H21 F3 N4 O2 S |
| Smiles: | CC(C)c1nncn1C1CCN(CC1)S(c1ccc(cc1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2982 |
| logD: | 3.2979 |
| logSw: | -3.591 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.406 |
| InChI Key: | JKUPGIRXFWJMNZ-UHFFFAOYSA-N |