Base information
| Cat. No. | |
| CAS No. | 117-89-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H24F3N3S |
| Molecular Weight | 407.496 |
| Exact Mass | 407.164 |
| XLogP3 | 4.8864 |
| Mr | 118.104 |
| PSA | 35.02 |
| Sequence | - |
| Atom number | 52 |
| Bond number | 55 |
| Ring number | 4 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F |
