N-[3-(4-methylpiperidin-1-yl)propyl]-N~3~-[(1-oxoisoquinolin-2(1H)-yl)acetyl]-beta-alaninamide

Chemical Structure Depiction of
N-[3-(4-methylpiperidin-1-yl)propyl]-N~3~-[(1-oxoisoquinolin-2(1H)-yl)acetyl]-beta-alaninamide
Available: 3 mg
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mg
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Compound characteristics

Compound ID: C197-0286
Compound Name: N-[3-(4-methylpiperidin-1-yl)propyl]-N~3~-[(1-oxoisoquinolin-2(1H)-yl)acetyl]-beta-alaninamide
Molecular Weight: 412.53
Molecular Formula: C23 H32 N4 O3
Smiles: CC1CCN(CCCNC(CCNC(CN2C=Cc3ccccc3C2=O)=O)=O)CC1
Stereo: ACHIRAL
logP: 0.5056
logD: -2.0126
logSw: -2.2477
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 2
Polar surface area: 68.29
InChI Key: RLQTWIPMFDEANM-UHFFFAOYSA-N
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