Base information
| Cat. No. | |
| CAS No. | 100622-41-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H11BrN2 |
| Molecular Weight | 287.155 |
| Exact Mass | 286.011 |
| XLogP3 | 3.9162 |
| Mr | 73.2467 |
| PSA | 28.68 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 30 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc(cc1)Cc1nc2c([nH]1)cccc2 |
