Base information
| Cat. No. | |
| CAS No. | 1258833-31-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H21N3O2S |
| Molecular Weight | 319.422 |
| Exact Mass | 319.135 |
| XLogP3 | 3.3449 |
| Mr | 95.0927 |
| PSA | 70.68 |
| Sequence | - |
| Atom number | 43 |
| Bond number | 45 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | C[C@@H]1CNCCCCN1S(=O)(=O)c1ccc2c(c1)ccnc2 |
