Base information
| Cat. No. | |
| CAS No. | 485842-97-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H9NO2S |
| Molecular Weight | 243.281 |
| Exact Mass | 243.035 |
| XLogP3 | 2.179 |
| Mr | 66.8038 |
| PSA | 78.43 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 28 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=C1C=CC(C=C1)(O)c1nc2c(s1)cccc2 |
