Base information
| Cat. No. | |
| CAS No. | 75737-39-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H13N5O |
| Molecular Weight | 255.275 |
| Exact Mass | 255.112 |
| XLogP3 | 2.0466 |
| Mr | 71.9684 |
| PSA | 75.72 |
| Sequence | - |
| Atom number | 32 |
| Bond number | 34 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COc1cccc(c1)CNc1ncnc2c1nc[nH]2 |