Base information
| Cat. No. | |
| CAS No. | 80354-00-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H3BrN2O2S |
| Molecular Weight | 247.069 |
| Exact Mass | 245.91 |
| XLogP3 | 1.8565 |
| Mr | 47.7283 |
| PSA | 82.84 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 16 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1cn2c(n1)sc(c2)Br |
