2-{[5-(1-benzofuran-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-ethyl-N-phenylacetamide
Chemical Structure Depiction of
2-{[5-(1-benzofuran-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-ethyl-N-phenylacetamide
2-{[5-(1-benzofuran-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-ethyl-N-phenylacetamide
Compound characteristics
| Compound ID: | J047-0066 |
| Compound Name: | 2-{[5-(1-benzofuran-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-ethyl-N-phenylacetamide |
| Molecular Weight: | 406.51 |
| Molecular Formula: | C22 H22 N4 O2 S |
| Smiles: | CCN(C(CSc1nnc(c2cc3ccccc3o2)n1CC)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7997 |
| logD: | 4.7997 |
| logSw: | -5.1124 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.35 |
| InChI Key: | SEGOXKVFCDEACD-UHFFFAOYSA-N |