Base information
| Cat. No. | |
| CAS No. | 451462-58-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H21N3O2S |
| Molecular Weight | 319.422 |
| Exact Mass | 319.135 |
| XLogP3 | 3.2632 |
| Mr | 95.2517 |
| PSA | 70.68 |
| Sequence | - |
| Atom number | 43 |
| Bond number | 45 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | C[C@H]1CNCCCN1S(=O)(=O)c1cccc2c1c(C)cnc2 |
