Base information
| Cat. No. | |
| CAS No. | 54239-37-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H17N3O |
| Molecular Weight | 219.283 |
| Exact Mass | 219.137 |
| XLogP3 | 2.14398 |
| Mr | 63.7189 |
| PSA | 82.07 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 33 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | N#Cc1cc(ccc1N)C(CNC(C)C)O |