1-(5-bromothiophene-2-sulfonyl)-4-[3-(propan-2-yl)-4H-1,2,4-triazol-4-yl]piperidine
Chemical Structure Depiction of
1-(5-bromothiophene-2-sulfonyl)-4-[3-(propan-2-yl)-4H-1,2,4-triazol-4-yl]piperidine
1-(5-bromothiophene-2-sulfonyl)-4-[3-(propan-2-yl)-4H-1,2,4-triazol-4-yl]piperidine
Compound characteristics
| Compound ID: | P939-5464 |
| Compound Name: | 1-(5-bromothiophene-2-sulfonyl)-4-[3-(propan-2-yl)-4H-1,2,4-triazol-4-yl]piperidine |
| Molecular Weight: | 419.36 |
| Molecular Formula: | C14 H19 Br N4 O2 S2 |
| Smiles: | CC(C)c1nncn1C1CCN(CC1)S(c1ccc(s1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9541 |
| logD: | 2.9539 |
| logSw: | -3.2596 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.424 |
| InChI Key: | MEGRYTHBCBVWLI-UHFFFAOYSA-N |