Base information
| Cat. No. | |
| CAS No. | 65897-46-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H11N3O4S |
| Molecular Weight | 317.32 |
| Exact Mass | 317.047 |
| XLogP3 | 2.7214 |
| Mr | 82.6232 |
| PSA | 116.77 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 35 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | O=C(C1=C(O)c2c(S(=O)(=O)N1)cccc2)Nc1ccccn1 |
