5-amino-3-{2-[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]-1-cyanoethenyl}-1-phenyl-1H-pyrazole-4-carbonitrile

Chemical Structure Depiction of
5-amino-3-{2-[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]-1-cyanoethenyl}-1-phenyl-1H-pyrazole-4-carbonitrile
Available: 18 mg
Amount:
mg
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Compound characteristics

Compound ID: 8009-4822
Compound Name: 5-amino-3-{2-[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]-1-cyanoethenyl}-1-phenyl-1H-pyrazole-4-carbonitrile
Molecular Weight: 475.3
Molecular Formula: C22 H15 Br N6 O2
Smiles: COc1cc(/C=C(C#N)/c2c(C#N)c(N)n(c3ccccc3)n2)cc(c1OCC#N)[Br]
Stereo: ACHIRAL
logP: 3.1918
logD: 3.1918
logSw: -3.3928
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 2
Polar surface area: 100.655
InChI Key: DZHYVGPHUIUGSJ-UHFFFAOYSA-N
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