Base information
| Cat. No. | |
| CAS No. | 1187385-63-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H8BrN3O |
| Molecular Weight | 302.126 |
| Exact Mass | 300.985 |
| XLogP3 | 3.5611 |
| Mr | 70.665 |
| PSA | 51.81 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 28 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | Brc1cncc(c1)c1nnc(o1)c1ccccc1 |
