Base information
| Cat. No. | |
| CAS No. | 2243127-08-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C37H46N2O4S |
| Molecular Weight | 614.837 |
| Exact Mass | 614.318 |
| XLogP3 | 7.7503 |
| Mr | 180.394 |
| PSA | 95.09 |
| Sequence | - |
| Atom number | 90 |
| Bond number | 95 |
| Ring number | 7 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | c1ccc(cc1)CN[C@@H]1C2CCN([C@@H]1C(c1ccccc1)c1ccccc1)CC2.O=C1C[C@@H]2C([C@]1(CC2)CS(=O)(=O)O)(C)C |
