methyl 4-fluoro-3-{[4-(trifluoromethoxy)phenyl]sulfamoyl}-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 4-fluoro-3-{[4-(trifluoromethoxy)phenyl]sulfamoyl}-1-benzothiophene-2-carboxylate
methyl 4-fluoro-3-{[4-(trifluoromethoxy)phenyl]sulfamoyl}-1-benzothiophene-2-carboxylate
Compound characteristics
Compound ID: | G226-0201 |
Compound Name: | methyl 4-fluoro-3-{[4-(trifluoromethoxy)phenyl]sulfamoyl}-1-benzothiophene-2-carboxylate |
Molecular Weight: | 449.4 |
Molecular Formula: | C17 H11 F4 N O5 S2 |
Smiles: | COC(c1c(c2c(cccc2s1)F)S(Nc1ccc(cc1)OC(F)(F)F)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 5.1253 |
logD: | 5.0691 |
logSw: | -5.2467 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.745 |
InChI Key: | WSTGWTPTRJYQHY-UHFFFAOYSA-N |