Base information
| Cat. No. | |
| CAS No. | 851195-35-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H17BrN2O2 |
| Molecular Weight | 361.233 |
| Exact Mass | 360.047 |
| XLogP3 | 4.06538 |
| Mr | 89.4045 |
| PSA | 55.02 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 40 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1c(c2ccc(cc2)Br)c(c(n1C)CC)C#N |
