Base information
| Cat. No. | |
| CAS No. | 77168-63-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H6N2S2 |
| Molecular Weight | 194.277 |
| Exact Mass | 193.997 |
| XLogP3 | 2.8677 |
| Mr | 52.7347 |
| PSA | 89.01 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 19 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | S=c1scc([nH]1)c1ccncc1 |
