Base information
| Cat. No. | |
| CAS No. | 142457-00-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H12BrN3S |
| Molecular Weight | 238.149 |
| Exact Mass | 236.994 |
| XLogP3 | 2.7745 |
| Mr | 54.0038 |
| PSA | 93.17 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | NCCc1sc(nc1C)N.Br |
