Base information
| Cat. No. | |
| CAS No. | 603-51-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H13N3O |
| Molecular Weight | 227.262 |
| Exact Mass | 227.106 |
| XLogP3 | 3.4992 |
| Mr | 66.9851 |
| PSA | 58.36 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 31 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | NNC(=O)N(c1ccccc1)c1ccccc1 |
