Base information
| Cat. No. | |
| CAS No. | 222021-56-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H14BrNO3S |
| Molecular Weight | 380.256 |
| Exact Mass | 378.988 |
| XLogP3 | 4.0003 |
| Mr | 89.5638 |
| PSA | 82.91 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 37 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc(c(c1)C(=O)O)Sc1ccccc1C(=O)N(C)C |
