Base information
| Cat. No. | |
| CAS No. | 125279-79-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H26N4O5S |
| Molecular Weight | 446.52 |
| Exact Mass | 446.162 |
| XLogP3 | 3.1968 |
| Mr | 117.53 |
| PSA | 123.09 |
| Sequence | - |
| Atom number | 57 |
| Bond number | 59 |
| Ring number | 3 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | O[C@H](COc1ccc(cc1)NS(=O)(=O)C)CNCCOc1ccc(cc1)n1cncc1 |
