Base information
| Cat. No. | |
| CAS No. | 84888-35-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H25NO4S |
| Molecular Weight | 399.503 |
| Exact Mass | 399.15 |
| XLogP3 | 4.9009 |
| Mr | 112.029 |
| PSA | 100.93 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 55 |
| Ring number | 3 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | O=C(OC(C)(C)C)N[C@H](C(=O)O)CSCC1c2ccccc2-c2c1cccc2 |
