Base information
| Cat. No. | |
| CAS No. | 5118-17-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H8ClN3O3S |
| Molecular Weight | 273.696 |
| Exact Mass | 272.997 |
| XLogP3 | -0.7055 |
| Mr | 70.4137 |
| PSA | 103.11 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 26 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)c1ccc(o1)c1csc2[n+]1CCN2.[Cl-] |
