Base information
| Cat. No. | |
| CAS No. | 2097381-85-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C27H33N5O4S |
| Molecular Weight | 523.647 |
| Exact Mass | 523.225 |
| XLogP3 | 3.25088 |
| Mr | 143.571 |
| PSA | 163.66 |
| Sequence | - |
| Atom number | 70 |
| Bond number | 73 |
| Ring number | 4 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | O[C@@H]1C[C@H](N(C1)C(=O)[C@H](C(C)(C)C)NC(=O)C1(CC1)C#N)C(=O)NCc1ccc(cc1)c1scnc1C |
