Base information
| Cat. No. | |
| CAS No. | 55268-75-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H16N4O8S |
| Molecular Weight | 424.385 |
| Exact Mass | 424.069 |
| XLogP3 | 0.4931 |
| Mr | 100.376 |
| PSA | 199.06 |
| Sequence | - |
| Atom number | 45 |
| Bond number | 47 |
| Ring number | 3 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | CO/N=C(\C(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)COC(=O)N)/c1ccco1 |
