Base information
| Cat. No. | |
| CAS No. | 1073062-42-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H13BrClN3 |
| Molecular Weight | 422.705 |
| Exact Mass | 420.998 |
| XLogP3 | 6.2885 |
| Mr | 108.845 |
| PSA | 38.67 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 42 |
| Ring number | 4 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | Clc1cc(Br)cc(c1)c1nc(nc(n1)c1ccccc1)c1ccccc1 |
