3-{2-[(5-bromofuran-2-carbonyl)amino]-3-phenylprop-2-enamido}benzoic acid

Chemical Structure Depiction of
3-{2-[(5-bromofuran-2-carbonyl)amino]-3-phenylprop-2-enamido}benzoic acid
Available: 187 mg
Amount:
mg
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Compound characteristics

Compound ID: 3379-2306
Compound Name: 3-{2-[(5-bromofuran-2-carbonyl)amino]-3-phenylprop-2-enamido}benzoic acid
Molecular Weight: 455.26
Molecular Formula: C21 H15 Br N2 O5
Smiles: C(=C(/C(Nc1cccc(c1)C(O)=O)=O)NC(c1ccc(o1)[Br])=O)/c1ccccc1
Stereo: ACHIRAL
logP: 4.5408
logD: 1.6549
logSw: -4.4408
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 3
Polar surface area: 82.588
InChI Key: BTKMNVSLRRQXSP-UHFFFAOYSA-N
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