Base information
| Cat. No. | |
| CAS No. | 85003-76-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H26N2O6S |
| Molecular Weight | 398.474 |
| Exact Mass | 398.151 |
| XLogP3 | 3.4057 |
| Mr | 102.637 |
| PSA | 139.26 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 53 |
| Ring number | 1 |
| Rotor number | 14 |
| Residues number | 0 |
| Canonical smiles | O=C(OCc1ccccc1)NCCSC[C@@H](C(=O)O)NC(=O)OC(C)(C)C |
