2-{[5-(1-benzofuran-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-{[5-(1-benzofuran-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
2-{[5-(1-benzofuran-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | J047-0129 |
| Compound Name: | 2-{[5-(1-benzofuran-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 444.49 |
| Molecular Formula: | C24 H17 F N4 O2 S |
| Smiles: | C(C(Nc1ccc(cc1)F)=O)Sc1nnc(c2cc3ccccc3o2)n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3308 |
| logD: | 5.3307 |
| logSw: | -6.3212 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.155 |
| InChI Key: | RHOUZSMTZKUGAK-UHFFFAOYSA-N |