HuagongsheHuagongshe Chemistry Print Report · For research reference only
Ethanone, 2-(5-furan-2-yl-[1,3,4]oxadiazol-2-ylsulfanyl)-1-(2,4,6-trimethylphenyl)-
2-{[5-(2-furyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-mesitylethanone
![Ethanone, 2-(5-furan-2-yl-[1,3,4]oxadiazol-2-ylsulfanyl)-1-(2,4,6-trimethylphenyl)- molecular structure](/img/chemical/178819877.png)
Identifiers & Physical Properties
| CAS No. | 632294-04-3 |
|---|---|
| Molecular formula | C17H16N2O3S |
| Average molar mass | 328.4 g/mol |
| SMILES | Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1 |
| InChIKey | UZOIPHWBWYOTID-UHFFFAOYSA-N |
Chemical & Physical Properties
| XLogP | 3.9 |
|---|---|
| Topological polar surface area | 94.4 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 6 |
| Rotatable bonds | 5 |
| Heavy atoms | 23 |
| Formal charge | 0 |
| Complexity | 411 |