Base information
| Cat. No. | |
| CAS No. | 1356842-10-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H11N3O6S |
| Molecular Weight | 337.308 |
| Exact Mass | 337.037 |
| XLogP3 | -1.3693 |
| Mr | 84.9865 |
| PSA | 150.67 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 36 |
| Ring number | 3 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | C=CC1=C(C(=O)O)N2[C@H](SC1)[C@@H](C2=O)NC(=O)C1=NOCC1=O |
