2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3,4-trifluorophenyl)acetamide
Chemical Structure Depiction of
2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3,4-trifluorophenyl)acetamide
2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3,4-trifluorophenyl)acetamide
Compound characteristics
| Compound ID: | J047-0023 |
| Compound Name: | 2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3,4-trifluorophenyl)acetamide |
| Molecular Weight: | 418.4 |
| Molecular Formula: | C19 H13 F3 N4 O2 S |
| Smiles: | Cn1c(c2cc3ccccc3o2)nnc1SCC(Nc1ccc(c(c1F)F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1826 |
| logD: | 3.7923 |
| logSw: | -4.2906 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.795 |
| InChI Key: | PYSIJYUFUVBZAA-UHFFFAOYSA-N |