Base information
| Cat. No. | |
| CAS No. | 117846-02-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H19N3O4S |
| Molecular Weight | 301.362 |
| Exact Mass | 301.11 |
| XLogP3 | 1.8814 |
| Mr | 79.0757 |
| PSA | 116.6 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 39 |
| Ring number | 1 |
| Rotor number | 10 |
| Residues number | 0 |
| Canonical smiles | CN(Cc1ccc(o1)CSCCNC(=O)C[N+](=O)[O-])C |
