Base information
| Cat. No. | |
| CAS No. | 1231952-71-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H9N3O3S |
| Molecular Weight | 287.294 |
| Exact Mass | 287.036 |
| XLogP3 | 3.282 |
| Mr | 77.8008 |
| PSA | 120.07 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 31 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OCc1cnc2c(c1)nc(s2)c1ccccc1[N+](=O)[O-] |
