Base information
| Cat. No. | |
| CAS No. | 1126745-90-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H27D3N6O4S |
| Molecular Weight | 477.595 |
| Exact Mass | 477.224 |
| XLogP3 | 2.5675 |
| Mr | 134.556 |
| PSA | 121.8 |
| Sequence | - |
| Atom number | 63 |
| Bond number | 66 |
| Ring number | 4 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)N1CCN(CC1)C([2H])([2H])[2H])C |
