Base information
| Cat. No. | |
| CAS No. | 454453-49-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H9F4N5O4S |
| Molecular Weight | 419.311 |
| Exact Mass | 419.031 |
| XLogP3 | 5.5577 |
| Mr | 97.7711 |
| PSA | 159.82 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 38 |
| Ring number | 2 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | S=C(Nc1ccc(cc1)F)NNc1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-] |
