Base information
| Cat. No. | |
| CAS No. | 847818-54-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H12BrN3 |
| Molecular Weight | 218.094 |
| Exact Mass | 217.021 |
| XLogP3 | 1.2072 |
| Mr | 48.506 |
| PSA | 21.06 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 23 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CN(CCn1ncc(c1)Br)C |
