Base information
| Cat. No. | |
| CAS No. | 84468-24-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H15N3O2S |
| Molecular Weight | 277.342 |
| Exact Mass | 277.088 |
| XLogP3 | 2.1762 |
| Mr | 80.6717 |
| PSA | 70.68 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 36 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=S(=O)(c1cccc2c1ccnc2)N1CCNCC1 |
