Base information
| Cat. No. | |
| CAS No. | 35035-05-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H22BrNOS2 |
| Molecular Weight | 400.397 |
| Exact Mass | 399.033 |
| XLogP3 | 1.0694 |
| Mr | 106.189 |
| PSA | 65.71 |
| Sequence | - |
| Atom number | 44 |
| Bond number | 45 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COC1CC(=C(c2cccs2)c2cccs2)C[N+](C1)(C)C.[Br-] |
