Base information
| Cat. No. | |
| CAS No. | 51987-99-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H6N4OS |
| Molecular Weight | 206.224 |
| Exact Mass | 206.026 |
| XLogP3 | 1.2584 |
| Mr | 51.9182 |
| PSA | 96.01 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | O=C(c1cccnc1)Nc1nncs1 |
