2-[3-(methylsulfanyl)phenyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Chemical Structure Depiction of
2-[3-(methylsulfanyl)phenyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
2-[3-(methylsulfanyl)phenyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Compound characteristics
| Compound ID: | K261-2774 |
| Compound Name: | 2-[3-(methylsulfanyl)phenyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione |
| Molecular Weight: | 320.39 |
| Molecular Formula: | C14 H12 N2 O3 S2 |
| Smiles: | CSc1cccc(c1)N1C(Nc2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6097 |
| logD: | 2.6094 |
| logSw: | -3.271 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.956 |
| InChI Key: | IAZFSLRVPCJUOC-UHFFFAOYSA-N |