Base information
| Cat. No. | |
| CAS No. | 1639208-54-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C31H46N2O7S |
| Molecular Weight | 590.771 |
| Exact Mass | 590.303 |
| XLogP3 | 6.5248 |
| Mr | 164.498 |
| PSA | 136.77 |
| Sequence | - |
| Atom number | 87 |
| Bond number | 89 |
| Ring number | 4 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | Cc1ccc(cc1)S(=O)(=O)O.COc1cc2c(cc1OC)CCN1[C@@H]2C[C@@H](OC(=O)[C@H](C(C)C)N)[C@@H](C1)CC(C)C |
