2-(2-{[5-(1-benzofuran-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)benzamide
Chemical Structure Depiction of
2-(2-{[5-(1-benzofuran-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)benzamide
2-(2-{[5-(1-benzofuran-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)benzamide
Compound characteristics
| Compound ID: | J047-0593 |
| Compound Name: | 2-(2-{[5-(1-benzofuran-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)benzamide |
| Molecular Weight: | 469.52 |
| Molecular Formula: | C25 H19 N5 O3 S |
| Smiles: | C(C(Nc1ccccc1C(N)=O)=O)Sc1nnc(c2cc3ccccc3o2)n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8892 |
| logD: | 3.8891 |
| logSw: | -4.2846 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.516 |
| InChI Key: | AKFMUFNWJDIHEQ-UHFFFAOYSA-N |