Base information
| Cat. No. | |
| CAS No. | 1416439-30-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H7BrN2 |
| Molecular Weight | 247.091 |
| Exact Mass | 245.979 |
| XLogP3 | 3.17738 |
| Mr | 59.124 |
| PSA | 36.68 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | N#Cc1cc(C)nc2c1cc(Br)cc2 |
