Base information
| Cat. No. | |
| CAS No. | 1332389-57-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H16F3N5O2S |
| Molecular Weight | 459.444 |
| Exact Mass | 459.098 |
| XLogP3 | 3.91338 |
| Mr | 118.977 |
| PSA | 121.42 |
| Sequence | - |
| Atom number | 48 |
| Bond number | 51 |
| Ring number | 4 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CNC(=O)c1ccc(cc1)N1C(=S)N(C(=O)C21CCC2)c1cnc(c(c1)C(F)(F)F)C#N |
