Base information
| Cat. No. | |
| CAS No. | 1169789-29-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H15BrN2O3 |
| Molecular Weight | 327.174 |
| Exact Mass | 326.027 |
| XLogP3 | 3.5906 |
| Mr | 76.127 |
| PSA | 53.35 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 35 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COc1cc(Br)cc2c1cnn2C(=O)OC(C)(C)C |
