3-chloro-4-fluoro-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
3-chloro-4-fluoro-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
3-chloro-4-fluoro-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | M070-0079 |
| Compound Name: | 3-chloro-4-fluoro-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide |
| Molecular Weight: | 388.89 |
| Molecular Formula: | C14 H10 Cl F N2 O2 S3 |
| Smiles: | CSc1nc2ccc(cc2s1)NS(c1ccc(c(c1)[Cl])F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5924 |
| logD: | 4.3095 |
| logSw: | -4.7054 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.97 |
| InChI Key: | YIGBNQROJHEKBF-UHFFFAOYSA-N |