Base information
| Cat. No. | |
| CAS No. | 1191900-58-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C25H27N3O3S |
| Molecular Weight | 449.565 |
| Exact Mass | 449.177 |
| XLogP3 | 4.7604 |
| Mr | 140.013 |
| PSA | 103 |
| Sequence | - |
| Atom number | 59 |
| Bond number | 63 |
| Ring number | 5 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | O=c1ccc2c([nH]1)cc(cc2)OCCCC[N+]1([O-])CCN(CC1)c1cccc2c1ccs2 |
