HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-(2-Amino-5-thiadiazolyl)-1-methyl-5-nitroimidazole
Identifiers & Physical Properties
| Molecular formula | C6H8N6O2S |
|---|---|
| Average molar mass | 228.23 g/mol |
| Monoisotopic mass | 228.04294469 g/mol |
| SMILES | Cn1c([N+](=O)[O-])cnc1C1=CNN(N)S1 |
| InChIKey | WJRXMOFXMJZTJG-UHFFFAOYSA-N |
| PubChem CID | 21390816 |
Chemical & Physical Properties
| XLogP | 0 |
|---|---|
| Topological polar surface area | 130 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 7 |
| Rotatable bonds | 1 |
| Heavy atoms | 15 |
| Formal charge | 0 |
| Complexity | 304 |