3-[8-fluoro-2-(4-fluorobenzene-1-sulfonyl)-1,2,3,4-tetrahydro-5H-pyrido[4,3-b]indol-5-yl]propanoic acid
Chemical Structure Depiction of
3-[8-fluoro-2-(4-fluorobenzene-1-sulfonyl)-1,2,3,4-tetrahydro-5H-pyrido[4,3-b]indol-5-yl]propanoic acid
3-[8-fluoro-2-(4-fluorobenzene-1-sulfonyl)-1,2,3,4-tetrahydro-5H-pyrido[4,3-b]indol-5-yl]propanoic acid
Compound characteristics
Compound ID: | H025-0218 |
Compound Name: | 3-[8-fluoro-2-(4-fluorobenzene-1-sulfonyl)-1,2,3,4-tetrahydro-5H-pyrido[4,3-b]indol-5-yl]propanoic acid |
Molecular Weight: | 420.43 |
Molecular Formula: | C20 H18 F2 N2 O4 S |
Smiles: | C(Cn1c2CCN(Cc2c2cc(ccc12)F)S(c1ccc(cc1)F)(=O)=O)C(O)=O |
Stereo: | ACHIRAL |
logP: | 2.7012 |
logD: | -0.0933 |
logSw: | -2.9644 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.43 |
InChI Key: | NJHIMQGHHQIXTE-UHFFFAOYSA-N |