4-[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)anilino]-4-oxobutanoic acid

Chemical Structure Depiction of
4-[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)anilino]-4-oxobutanoic acid
Available: 12 mg
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mg
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Compound characteristics

Compound ID: Y205-5790
Compound Name: 4-[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)anilino]-4-oxobutanoic acid
Molecular Weight: 388.44
Molecular Formula: C19 H20 N2 O5 S
Smiles: C(CC(Nc1ccc(cc1)S(N1CCc2ccccc2C1)(=O)=O)=O)C(O)=O
Stereo: ACHIRAL
logP: 1.9259
logD: -1.0235
logSw: -2.6607
Hydrogen bond acceptors count: 10
Hydrogen bond donors count: 2
Polar surface area: 83.145
InChI Key: BXESGTWWZLOXHR-UHFFFAOYSA-N
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