Base information
| Cat. No. | |
| CAS No. | 174709-30-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H12BrN5 |
| Molecular Weight | 354.204 |
| Exact Mass | 353.028 |
| XLogP3 | 4.0956 |
| Mr | 91.3347 |
| PSA | 55.63 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 37 |
| Ring number | 4 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | Brc1cccc(c1)Nc1ncnc2c1cc1ncn(c1c2)C |
