Base information
| Cat. No. | |
| CAS No. | 54029-12-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H15N3O3S |
| Molecular Weight | 281.331 |
| Exact Mass | 281.083 |
| XLogP3 | 3.1975 |
| Mr | 73.9019 |
| PSA | 103.29 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 35 |
| Ring number | 2 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CCCS(=O)c1ccc2c(c1)[nH]c(n2)NC(=O)OC |
