Base information
| Cat. No. | |
| CAS No. | 52431-78-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6N4OS |
| Molecular Weight | 194.214 |
| Exact Mass | 194.026 |
| XLogP3 | 1.0305 |
| Mr | 48.5667 |
| PSA | 98.82 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Oc1ccc(cc1)n1[nH]nnc1=S |
