methyl 3-[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfamoyl]-4-fluoro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfamoyl]-4-fluoro-1-benzothiophene-2-carboxylate
methyl 3-[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfamoyl]-4-fluoro-1-benzothiophene-2-carboxylate
Compound characteristics
Compound ID: | G226-0204 |
Compound Name: | methyl 3-[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfamoyl]-4-fluoro-1-benzothiophene-2-carboxylate |
Molecular Weight: | 423.44 |
Molecular Formula: | C18 H14 F N O6 S2 |
Smiles: | COC(c1c(c2c(cccc2s1)F)S(Nc1ccc2c(c1)OCCO2)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.8735 |
logD: | 2.5089 |
logSw: | -3.5894 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.632 |
InChI Key: | LBDDETRNVBMPTG-UHFFFAOYSA-N |