3-bromo-N-[(3-methoxyphenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)

Chemical Structure Depiction of
3-bromo-N-[(3-methoxyphenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Available: 28 mg
Amount:
mg
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Compound characteristics

Compound ID: F594-0488
Compound Name: 3-bromo-N-[(3-methoxyphenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Molecular Weight: 574.39
Molecular Formula: C22 H26 Br N3 O3
Salt: CF3COOH
Smiles: COc1cccc(CN(CCC(N2CCNCC2)=O)C(c2cccc(c2)[Br])=O)c1
Stereo: ACHIRAL
logP: 1.9281
logD: 1.1001
logSw: -2.6333
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 1
Polar surface area: 52.053
InChI Key: NYQIWPODGCHDJN-UHFFFAOYSA-N
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