Base information
| Cat. No. | |
| CAS No. | 2100864-57-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H9N3O |
| Molecular Weight | 235.241 |
| Exact Mass | 235.075 |
| XLogP3 | 2.66328 |
| Mr | 68.251 |
| PSA | 58.8 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 29 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#Cc1c(OC)ncc2c1nc1ccccc1c2 |
