4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-nitrobenzoic acid

Chemical Structure Depiction of
4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-nitrobenzoic acid
Available: 33 mg
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mg
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Compound characteristics

Compound ID: K781-0469
Compound Name: 4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-nitrobenzoic acid
Molecular Weight: 346.34
Molecular Formula: C17 H18 N2 O6
Smiles: COc1ccc(CCNc2ccc(cc2[N+]([O-])=O)C(O)=O)cc1OC
Stereo: ACHIRAL
logP: 2.9445
logD: 0.1248
logSw: -3.3664
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 2
Polar surface area: 86.366
InChI Key: KOCALSLUENBTBQ-UHFFFAOYSA-N
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