Base information
| Cat. No. | |
| CAS No. | 1488-48-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6N4O2 |
| Molecular Weight | 178.148 |
| Exact Mass | 178.049 |
| XLogP3 | 0.8195 |
| Mr | 45.2524 |
| PSA | 104.89 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1c[nH]c2c1c(N)ncn2 |
