methyl 2-(4-chloroanilino)-5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate

Chemical Structure Depiction of
methyl 2-(4-chloroanilino)-5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Available: 20 mg
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mg
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Compound characteristics

Compound ID: V022-9974
Compound Name: methyl 2-(4-chloroanilino)-5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Molecular Weight: 431.89
Molecular Formula: C21 H18 Cl N O5 S
Smiles: CCOc1cc(\C=C2/C(C(=C(Nc3ccc(cc3)[Cl])S2)C(=O)OC)=O)ccc1O
Stereo: ACHIRAL
logP: 4.7054
logD: 4.2756
logSw: -4.7091
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 2
Polar surface area: 66.296
InChI Key: ZHPZGUGQXDFMFR-UHFFFAOYSA-N
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