3-[({4-[2-(butylamino)-2-oxoethyl]piperazin-1-yl}{[(4-methylphenyl)methyl]amino}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)

Chemical Structure Depiction of
3-[({4-[2-(butylamino)-2-oxoethyl]piperazin-1-yl}{[(4-methylphenyl)methyl]amino}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
Available: 5 mg
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mg
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Compound characteristics

Compound ID: G696-5872
Compound Name: 3-[({4-[2-(butylamino)-2-oxoethyl]piperazin-1-yl}{[(4-methylphenyl)methyl]amino}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
Molecular Weight: 579.62
Molecular Formula: C26 H35 N5 O3
Salt: CF3COOH
Smiles: CCCCNC(CN1CCN(CC1)C(\NCc1ccc(C)cc1)=N/c1cccc(c1)C(O)=O)=O
Stereo: ACHIRAL
logP: 4.1141
logD: 4.1141
logSw: -3.877
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 3
Polar surface area: 77.82
InChI Key: BNSCSAWKCSASSK-UHFFFAOYSA-N
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