Base information
| Cat. No. | |
| CAS No. | 1803573-21-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H26BrN2O7S- |
| Molecular Weight | 542.42 |
| Exact Mass | 541.064 |
| XLogP3 | 6.481 |
| Mr | 126.433 |
| PSA | 134.31 |
| Sequence | - |
| Atom number | 59 |
| Bond number | 60 |
| Ring number | 2 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | Brc1cnc(c(c1)c1cc(C)ccc1S(=O)(=O)[O-])N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C |
