4-[3-(propan-2-yl)-4H-1,2,4-triazol-4-yl]-1-(4-propylbenzene-1-sulfonyl)piperidine
Chemical Structure Depiction of
4-[3-(propan-2-yl)-4H-1,2,4-triazol-4-yl]-1-(4-propylbenzene-1-sulfonyl)piperidine
4-[3-(propan-2-yl)-4H-1,2,4-triazol-4-yl]-1-(4-propylbenzene-1-sulfonyl)piperidine
Compound characteristics
| Compound ID: | P939-5354 |
| Compound Name: | 4-[3-(propan-2-yl)-4H-1,2,4-triazol-4-yl]-1-(4-propylbenzene-1-sulfonyl)piperidine |
| Molecular Weight: | 376.52 |
| Molecular Formula: | C19 H28 N4 O2 S |
| Smiles: | CCCc1ccc(cc1)S(N1CCC(CC1)n1cnnc1C(C)C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8307 |
| logD: | 3.8305 |
| logSw: | -3.8009 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.406 |
| InChI Key: | VJJKXWCFRYPWDW-UHFFFAOYSA-N |