Base information
| Cat. No. | |
| CAS No. | 2232180-74-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H12BrN3O2 |
| Molecular Weight | 382.211 |
| Exact Mass | 381.011 |
| XLogP3 | 4.7229 |
| Mr | 94.663 |
| PSA | 61.04 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 39 |
| Ring number | 4 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1ccc2c(c1)ncc(c2)c1onc(n1)c1ccc(cc1)Br |
