Base information
| Cat. No. | |
| CAS No. | 845879-02-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H8BrN3S4 |
| Molecular Weight | 390.365 |
| Exact Mass | 388.878 |
| XLogP3 | 5.04168 |
| Mr | 92.078 |
| PSA | 153.18 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | N#C/N=C(/SCSc1nc2c(s1)cc(cc2)Br)\SC |
