Base information
| Cat. No. | |
| CAS No. | 111139-55-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H22N2O4S2 |
| Molecular Weight | 442.551 |
| Exact Mass | 442.102 |
| XLogP3 | 5.112 |
| Mr | 121.768 |
| PSA | 183.12 |
| Sequence | - |
| Atom number | 52 |
| Bond number | 54 |
| Ring number | 4 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | OC(=O)[C@@H](Cc1csc2c1cccc2)N.OC(=O)[C@@H](Cc1csc2c1cccc2)N |
