3-(2H-1,3-benzodioxol-5-yl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid

Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
Available: 28 mg
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mg
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Compound characteristics

Compound ID: Y043-7043
Compound Name: 3-(2H-1,3-benzodioxol-5-yl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
Molecular Weight: 325.32
Molecular Formula: C18 H15 N O5
Smiles: CN1C(C(C(O)=O)c2ccccc2C1=O)c1ccc2c(c1)OCO2
Stereo: MIXTURE OF STEREOISOMERS
logP: 1.7366
logD: -0.9851
logSw: -2.4999
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 1
Polar surface area: 61.212
InChI Key: WTYHJVRWDIGCCZ-UHFFFAOYSA-N
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