Base information
| Cat. No. | |
| CAS No. | 134698-42-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H11BrN4O |
| Molecular Weight | 319.157 |
| Exact Mass | 318.012 |
| XLogP3 | 3.1658 |
| Mr | 82.6262 |
| PSA | 58.12 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 32 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CCN1c2ncc(cc2C(=O)Nc2c1nccc2)Br |
