Base information
| Cat. No. | |
| CAS No. | 33142-18-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H8N2S |
| Molecular Weight | 176.238 |
| Exact Mass | 176.041 |
| XLogP3 | 2.9597 |
| Mr | 51.6577 |
| PSA | 53.16 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | c1ccc(cc1)Nc1nccs1 |
