Base information
| Cat. No. | |
| CAS No. | 1031370-96-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H7N3O2 |
| Molecular Weight | 249.224 |
| Exact Mass | 249.054 |
| XLogP3 | 2.78448 |
| Mr | 70.196 |
| PSA | 82.5 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 27 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#Cc1cc(C#Cc2ccccn2)cc(c1)[N+](=O)[O-] |
