Base information
| Cat. No. | |
| CAS No. | 511296-88-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H17BrN2S |
| Molecular Weight | 349.289 |
| Exact Mass | 348.03 |
| XLogP3 | 5.2081 |
| Mr | 90.942 |
| PSA | 45.54 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 39 |
| Ring number | 4 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Cc1ccc(cc1)c1cn2c(n1)sc1c2CCCC1.Br |
