Base information
| Cat. No. | |
| CAS No. | 1093819-50-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H16BN3O2 |
| Molecular Weight | 245.085 |
| Exact Mass | 245.134 |
| XLogP3 | 1.2571 |
| Mr | 70.3647 |
| PSA | 60.03 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 36 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CC1(C)OB(OC1(C)C)c1cnc2c(c1)cn[nH]2 |
