Base information
| Cat. No. | |
| CAS No. | 1438-45-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H14N2S |
| Molecular Weight | 182.286 |
| Exact Mass | 182.088 |
| XLogP3 | 2.9607 |
| Mr | 53.3407 |
| PSA | 53.16 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 27 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | C1CCC(CC1)Nc1nccs1 |
