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

Chemical Structure Depiction of
4-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}-3-[(thiophene-2-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Available: 12 mg
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mg
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Compound characteristics

Compound ID: F292-0673
Compound Name: 4-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}-3-[(thiophene-2-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Molecular Weight: 592.61
Molecular Formula: C21 H26 N4 O5 S2
Salt: CF3COOH
Smiles: C1CCN(C1)C(CN1CCN(CC1)c1ccc(cc1NS(c1cccs1)(=O)=O)C(O)=O)=O
Stereo: ACHIRAL
logP: 2.3689
logD: 0.431
logSw: -2.7839
Hydrogen bond acceptors count: 10
Hydrogen bond donors count: 2
Polar surface area: 93.067
InChI Key: CXUMJKRFOVDAQM-UHFFFAOYSA-N
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