Base information
| Cat. No. | |
| CAS No. | 21593-23-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H17N3O6S2 |
| Molecular Weight | 423.463 |
| Exact Mass | 423.056 |
| XLogP3 | 0.8042 |
| Mr | 104.793 |
| PSA | 176.5 |
| Sequence | - |
| Atom number | 45 |
| Bond number | 47 |
| Ring number | 3 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | O=C(N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)COC(=O)C)CSc1ccncc1 |
