Base information
| Cat. No. | |
| CAS No. | 5098-14-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H11N3O3S |
| Molecular Weight | 253.278 |
| Exact Mass | 253.052 |
| XLogP3 | 2.38366 |
| Mr | 60.0072 |
| PSA | 136.35 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 27 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Cc1ccc(cc1)S(=O)(=O)O.NC(C#N)C#N |
