Base information
| Cat. No. | |
| CAS No. | 1233339-22-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H24N4O3S |
| Molecular Weight | 412.505 |
| Exact Mass | 412.157 |
| XLogP3 | 4.0295 |
| Mr | 115.979 |
| PSA | 96.56 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 57 |
| Ring number | 5 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | C[C@@H]1COCCN1c1cc(nc(n1)c1cccc2c1cc[nH]2)C1(CC1)S(=O)(=O)C |
