Base information
| Cat. No. | |
| CAS No. | 1086063-18-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H8BrN3 |
| Molecular Weight | 286.127 |
| Exact Mass | 284.99 |
| XLogP3 | 3.4543 |
| Mr | 70.469 |
| PSA | 38.67 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 27 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc2c(c1)c(ccn2)c1ccnnc1 |
