Base information
| Cat. No. | |
| CAS No. | 169050-05-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6BrNS |
| Molecular Weight | 240.12 |
| Exact Mass | 238.94 |
| XLogP3 | 3.5726 |
| Mr | 55.25 |
| PSA | 41.13 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 19 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc(s1)c1cccnc1 |
