Base information
| Cat. No. | |
| CAS No. | 19387-91-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H13N3O4S |
| Molecular Weight | 247.272 |
| Exact Mass | 247.063 |
| XLogP3 | 2.1384 |
| Mr | 60.662 |
| PSA | 106.16 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 29 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CCS(=O)(=O)CCn1c(C)ncc1[N+](=O)[O-] |
