2-{[4-methyl-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
2-{[4-methyl-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
2-{[4-methyl-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y205-9027 |
| Compound Name: | 2-{[4-methyl-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 276.36 |
| Molecular Formula: | C13 H16 N4 O S |
| Smiles: | Cn1c(CCc2ccccc2)nnc1SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2006 |
| logD: | 1.2006 |
| logSw: | -1.9068 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.686 |
| InChI Key: | RAUIKWUBNXOSKR-UHFFFAOYSA-N |