Base information
| Cat. No. | |
| CAS No. | 5800-19-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C19H21N3S |
| Molecular Weight | 323.455 |
| Exact Mass | 323.146 |
| XLogP3 | 3.0967 |
| Mr | 108.096 |
| PSA | 44.14 |
| Sequence | - |
| Atom number | 44 |
| Bond number | 47 |
| Ring number | 4 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CN1CCN(CC1)C1=Nc2ccccc2Sc2c1cc(C)cc2 |
