methyl 3-[4-(4-chlorophenyl)piperazine-1-sulfonyl]-4-fluoro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[4-(4-chlorophenyl)piperazine-1-sulfonyl]-4-fluoro-1-benzothiophene-2-carboxylate
methyl 3-[4-(4-chlorophenyl)piperazine-1-sulfonyl]-4-fluoro-1-benzothiophene-2-carboxylate
Compound characteristics
Compound ID: | G226-0246 |
Compound Name: | methyl 3-[4-(4-chlorophenyl)piperazine-1-sulfonyl]-4-fluoro-1-benzothiophene-2-carboxylate |
Molecular Weight: | 468.95 |
Molecular Formula: | C20 H18 Cl F N2 O4 S2 |
Smiles: | COC(c1c(c2c(cccc2s1)F)S(N1CCN(CC1)c1ccc(cc1)[Cl])(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.5343 |
logD: | 4.5343 |
logSw: | -4.8457 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 57.13 |
InChI Key: | WGXKQTUKPJEOKR-UHFFFAOYSA-N |