2-[(5-methylfuran-2-yl)methyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid

Chemical Structure Depiction of
2-[(5-methylfuran-2-yl)methyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid
Available: 306 mg
Amount:
mg
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Compound characteristics

Compound ID: P773-1232
Compound Name: 2-[(5-methylfuran-2-yl)methyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid
Molecular Weight: 283.28
Molecular Formula: C16 H13 N O4
Smiles: Cc1ccc(CN2C=C(C(O)=O)c3ccccc3C2=O)o1
Stereo: ACHIRAL
logP: 1.3497
logD: -2.9551
logSw: -2.2812
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 1
Polar surface area: 51.871
InChI Key: IRIHRHJNTHBISO-UHFFFAOYSA-N
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