Base information
| Cat. No. | |
| CAS No. | 1265848-98-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H13N3O2 |
| Molecular Weight | 231.251 |
| Exact Mass | 231.101 |
| XLogP3 | 0.8247 |
| Mr | 68.0907 |
| PSA | 58.22 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 32 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=c1[nH]cnc2c1ccc(c2)N1CCOCC1 |
