Base information
| Cat. No. | |
| CAS No. | 663598-85-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H13N3O6S2 |
| Molecular Weight | 371.389 |
| Exact Mass | 371.025 |
| XLogP3 | 2.5786 |
| Mr | 92.402 |
| PSA | 172.99 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 38 |
| Ring number | 2 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | O=C(ON1C(=O)CCC1=O)CCCSSc1ccc(cn1)[N+](=O)[O-] |
