Base information
| Cat. No. | |
| CAS No. | 100451-24-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H19N3O2S |
| Molecular Weight | 281.374 |
| Exact Mass | 281.12 |
| XLogP3 | 2.4305 |
| Mr | 79.2885 |
| PSA | 80.62 |
| Sequence | - |
| Atom number | 38 |
| Bond number | 39 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1cnc(nc1N1CCCCC1)SC |
