3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}-1-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperidine
Chemical Structure Depiction of
3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}-1-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperidine
3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}-1-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperidine
Compound characteristics
| Compound ID: | T501-0388 |
| Compound Name: | 3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}-1-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperidine |
| Molecular Weight: | 380.51 |
| Molecular Formula: | C17 H28 N6 O2 S |
| Smiles: | CC(C)n1cnnc1CC1CCCN(C1)S(c1c(C)nn(C)c1C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4878 |
| logD: | 0.4863 |
| logSw: | -1.2601 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.846 |
| InChI Key: | HOLHJDVRGZRWKS-OAHLLOKOSA-N |