2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y502-3714 |
| Compound Name: | 2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 308.4 |
| Molecular Formula: | C13 H20 N6 O S |
| Smiles: | CC(C)Cn1c(c2cc(C)n(C)n2)nnc1SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9098 |
| logD: | 0.9098 |
| logSw: | -1.5715 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.387 |
| InChI Key: | NAXYQDJRKNXLKQ-UHFFFAOYSA-N |