3-(4-methylbenzamido)-4-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}benzoic acid--trifluoroacetic acid (1/1)

Chemical Structure Depiction of
3-(4-methylbenzamido)-4-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}benzoic acid--trifluoroacetic acid (1/1)
Available: 2 mg
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mg
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Compound characteristics

Compound ID: F086-0079
Compound Name: 3-(4-methylbenzamido)-4-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}benzoic acid--trifluoroacetic acid (1/1)
Molecular Weight: 564.56
Molecular Formula: C25 H30 N4 O4
Salt: CF3COOH
Smiles: Cc1ccc(cc1)C(Nc1cc(ccc1N1CCN(CC1)CC(N1CCCC1)=O)C(O)=O)=O
Stereo: ACHIRAL
logP: 3.2935
logD: 1.3991
logSw: -3.2568
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 2
Polar surface area: 74.49
InChI Key: IGNGPSANMYNMCB-UHFFFAOYSA-N
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