Base information
| Cat. No. | |
| CAS No. | 1114823-87-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H11N3O4 |
| Molecular Weight | 261.233 |
| Exact Mass | 261.075 |
| XLogP3 | -0.6549 |
| Mr | 66.9185 |
| PSA | 83.19 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 32 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=C1OCCc2c1nc1c(c2)c(=O)n(c(=O)n1C)C |
