Base information
| Cat. No. | |
| CAS No. | 1029521-30-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H11F2N3OS |
| Molecular Weight | 319.329 |
| Exact Mass | 319.059 |
| XLogP3 | 3.08948 |
| Mr | 78.1627 |
| PSA | 94.84 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 35 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | N#Cc1c(=O)[nH]c(nc1C1CC1)SCc1cccc(c1F)F |
