3-chloro-4-fluoro-N-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]benzamide
Chemical Structure Depiction of
3-chloro-4-fluoro-N-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]benzamide
3-chloro-4-fluoro-N-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]benzamide
Compound characteristics
Compound ID: | M073-0804 |
Compound Name: | 3-chloro-4-fluoro-N-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]benzamide |
Molecular Weight: | 412.89 |
Molecular Formula: | C17 H14 Cl F N2 O3 S2 |
Smiles: | CC(C)S(c1nc2ccc(cc2s1)NC(c1ccc(c(c1)[Cl])F)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.2896 |
logD: | 4.1721 |
logSw: | -4.5857 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.597 |
InChI Key: | PYHAJQUSNCLKSW-UHFFFAOYSA-N |