Base information
| Cat. No. | |
| CAS No. | 2098902-68-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H7N5O |
| Molecular Weight | 225.206 |
| Exact Mass | 225.065 |
| XLogP3 | 0.75088 |
| Mr | 60.7947 |
| PSA | 86.84 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 26 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | N#Cc1c(C)nn2c1[nH]c(=O)c1c2nccc1 |
