Base information
| Cat. No. | |
| CAS No. | 1246372-66-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H16BN3O2 |
| Molecular Weight | 245.085 |
| Exact Mass | 245.134 |
| XLogP3 | 1.41588 |
| Mr | 69.8324 |
| PSA | 81.16 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 35 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#Cc1cc(cnc1N)B1OC(C(O1)(C)C)(C)C |
