Base information
| Cat. No. | |
| CAS No. | 1138513-35-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H7BrClN3O2 |
| Molecular Weight | 304.528 |
| Exact Mass | 302.941 |
| XLogP3 | 2.3219 |
| Mr | 61.7835 |
| PSA | 56.49 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 24 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1cnc2n(c1Cl)ncc2Br |
