Base information
| Cat. No. | |
| CAS No. | 100827-79-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H15BrClNO4S |
| Molecular Weight | 444.727 |
| Exact Mass | 442.959 |
| XLogP3 | 4.1445 |
| Mr | 102.058 |
| PSA | 100.71 |
| Sequence | - |
| Atom number | 40 |
| Bond number | 41 |
| Ring number | 2 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | BrCC(=O)Nc1sc(cc1C(=O)c1ccccc1Cl)CCC(=O)OC |
