2-({5-(1-methyl-1H-pyrazol-3-yl)-4-[(oxolan-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
2-({5-(1-methyl-1H-pyrazol-3-yl)-4-[(oxolan-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
2-({5-(1-methyl-1H-pyrazol-3-yl)-4-[(oxolan-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | Y502-4079 |
| Compound Name: | 2-({5-(1-methyl-1H-pyrazol-3-yl)-4-[(oxolan-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 322.39 |
| Molecular Formula: | C13 H18 N6 O2 S |
| Smiles: | Cn1ccc(c2nnc(n2CC2CCCO2)SCC(N)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.547 |
| logD: | -0.547 |
| logSw: | -1.5052 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.975 |
| InChI Key: | UYEVAHDWRQGSCD-SECBINFHSA-N |