Base information
| Cat. No. | |
| CAS No. | 5581-52-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H8N8O2S |
| Molecular Weight | 292.277 |
| Exact Mass | 292.049 |
| XLogP3 | 1.8324 |
| Mr | 72.5221 |
| PSA | 169.42 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 30 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | Nc1nc(Sc2n(C)cnc2[N+](=O)[O-])c2c(n1)[nH]cn2 |
