Base information
| Cat. No. | |
| CAS No. | 77628-52-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H8N2O2S |
| Molecular Weight | 244.269 |
| Exact Mass | 244.031 |
| XLogP3 | 2.761 |
| Mr | 65.4643 |
| PSA | 82.84 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 27 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1c(nc2n1ccs2)c1ccccc1 |
