2-(2-chlorobenzamido)-5-[4-(2-cyanoethyl)piperazin-1-yl]benzoic acid

Chemical Structure Depiction of
2-(2-chlorobenzamido)-5-[4-(2-cyanoethyl)piperazin-1-yl]benzoic acid
Available: 24 mg
Amount:
mg
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Compound characteristics

Compound ID: F687-0018
Compound Name: 2-(2-chlorobenzamido)-5-[4-(2-cyanoethyl)piperazin-1-yl]benzoic acid
Molecular Weight: 412.87
Molecular Formula: C21 H21 Cl N4 O3
Smiles: C(CN1CCN(CC1)c1ccc(c(c1)C(O)=O)NC(c1ccccc1[Cl])=O)C#N
Stereo: ACHIRAL
logP: 2.4634
logD: -1.6528
logSw: -3.2877
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 2
Polar surface area: 75.775
InChI Key: ZSEDIJBIOGJACM-UHFFFAOYSA-N
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