2-[5-(benzylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]-N-phenylacetamide
Chemical Structure Depiction of
2-[5-(benzylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]-N-phenylacetamide
2-[5-(benzylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]-N-phenylacetamide
Compound characteristics
| Compound ID: | F166-0757 |
| Compound Name: | 2-[5-(benzylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]-N-phenylacetamide |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C23 H20 N4 O S |
| Smiles: | C(C(Nc1ccccc1)=O)c1nnc(n1c1ccccc1)SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7369 |
| logD: | 3.7369 |
| logSw: | -4.1379 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.838 |
| InChI Key: | QEBLJKOKVCTTMP-UHFFFAOYSA-N |