Base information
| Cat. No. | |
| CAS No. | 80691-81-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H14N2O4S |
| Molecular Weight | 258.294 |
| Exact Mass | 258.067 |
| XLogP3 | 2.4283 |
| Mr | 65.3008 |
| PSA | 132.88 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 31 |
| Ring number | 1 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1c(N)sc(c1C(=O)OCC)N |
