Base information
| Cat. No. | |
| CAS No. | 1253790-88-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H9N3O3 |
| Molecular Weight | 279.25 |
| Exact Mass | 279.064 |
| XLogP3 | 1.0449 |
| Mr | 76.808 |
| PSA | 77.99 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 32 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | C#CCn1c(=O)oc(=O)c2c1nc(nc2)c1ccccc1 |
