3-(4-benzylpiperazin-1-yl)-N-(4-fluorophenyl)-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-(4-benzylpiperazin-1-yl)-N-(4-fluorophenyl)-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
3-(4-benzylpiperazin-1-yl)-N-(4-fluorophenyl)-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
Compound characteristics
Compound ID: | J087-0517 |
Compound Name: | 3-(4-benzylpiperazin-1-yl)-N-(4-fluorophenyl)-1,1-dioxo-1H-1-benzothiophene-2-carboxamide |
Molecular Weight: | 477.56 |
Molecular Formula: | C26 H24 F N3 O3 S |
Smiles: | C1CN(CCN1Cc1ccccc1)C1=C(C(Nc2ccc(cc2)F)=O)S(c2ccccc12)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7023 |
logD: | 3.6933 |
logSw: | -4.0913 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.507 |
InChI Key: | BFEUYDPHPHUCRD-UHFFFAOYSA-N |