Base information
| Cat. No. | |
| CAS No. | 68-91-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C32H41N2O5S2+ |
| Molecular Weight | 597.808 |
| Exact Mass | 597.246 |
| XLogP3 | 5.8821 |
| Mr | 171.621 |
| PSA | 128.67 |
| Sequence | - |
| Atom number | 82 |
| Bond number | 87 |
| Ring number | 7 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | O=C1N(Cc2ccccc2)C2C(N1Cc1ccccc1)C[S+]1C2CCC1.O=C1C[C@H]2C([C@@]1(CC2)CS(=O)(=O)O)(C)C |
