Base information
| Cat. No. | |
| CAS No. | 1476-48-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H11N7O4S |
| Molecular Weight | 349.325 |
| Exact Mass | 349.059 |
| XLogP3 | 2.8394 |
| Mr | 85.998 |
| PSA | 201.6 |
| Sequence | - |
| Atom number | 35 |
| Bond number | 37 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | Nc1nc(N)c2c(n1)nc(c(n2)c1ccc(cc1)OS(=O)(=O)O)N |
