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<compound>
  <id type="integer">103008</id>
  <title nil="true"/>
  <common-name>2,2'-[[1,1'-Biphenyl]-4,4'-diylbis(azo)]bis[N-(4-chlorophenyl)-3-oxobutyramide]</common-name>
  <description>2,2'-[[1,1'-Biphenyl]-4,4'-diylbis(azo)]bis[N-(4-chlorophenyl)-3-oxobutyramide] belongs to the biphenyls and derivatives, a subclass of benzene and substituted derivatives within the organic compounds. It is classified as a benzenoid with the formula C32H26Cl2N6O4. With an average molecular weight of 629.50 g/mol, 2,2'-[[1,1'-Biphenyl]-4,4'-diylbis(azo)]bis[N-(4-chlorophenyl)-3-oxobutyramide] is a heavy molecule.</description>
  <cas>94249-03-3</cas>
  <pubchem-id>57356734</pubchem-id>
  <chemical-formula>C32H26Cl2N6O4</chemical-formula>
  <weight>629.5</weight>
  <appearance nil="true"/>
  <melting-point nil="true"/>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility nil="true"/>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure nil="true"/>
  <target nil="true"/>
  <mechanism-of-toxicity nil="true"/>
  <metabolism nil="true"/>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity nil="true"/>
  <use-source nil="true"/>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2026-04-05T10:12:00Z</created-at>
  <updated-at type="dateTime">2026-08-31T18:04:26Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id nil="true"/>
  <omim-id nil="true"/>
  <chebi-id nil="true"/>
  <biocyc-id nil="true"/>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <drugbank-id nil="true"/>
  <pdb-id nil="true"/>
  <actor-id nil="true"/>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>CC(=O)C(N=NC1=CC=C(C=C1)C1=CC=C(C=C1)N=NC(C(C)=O)C(=O)NC1=CC=C(Cl)C=C1)C(=O)NC1=CC=C(Cl)C=C1</moldb-smiles>
  <moldb-formula>C32H26Cl2N6O4</moldb-formula>
  <moldb-inchi>InChI=1/C32H26Cl2N6O4/c1-19(41)29(31(43)35-25-15-7-23(33)8-16-25)39-37-27-11-3-21(4-12-27)22-5-13-28(14-6-22)38-40-30(20(2)42)32(44)36-26-17-9-24(34)10-18-26/h3-18,29-30H,1-2H3,(H,35,43)(H,36,44)</moldb-inchi>
  <moldb-inchikey>UPSAJZSSQKUOAT-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">629.5</moldb-average-mass>
  <moldb-mono-mass type="decimal">628.1392587</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>8.1</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
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  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM098901</chemdb-id>
  <dsstox-id>DTXSID90915876</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00066559</susdat-id>
  <iupac>2-[[4-[4-[[1-(4-chloroanilino)-1,3-dioxobutan-2-yl]diazenyl]phenyl]phenyl]diazenyl]-N-(4-chlorophenyl)-3-oxobutanamide</iupac>
  <moldb-polar-surface-area nil="true"/>
  <moldb-refractivity nil="true"/>
  <moldb-polarizability nil="true"/>
  <moldb-rotatable-bond-count nil="true"/>
  <moldb-acceptor-count nil="true"/>
  <moldb-donor-count nil="true"/>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic nil="true"/>
  <moldb-physiological-charge nil="true"/>
  <moldb-number-of-rings nil="true"/>
  <moldb-alogps-logp nil="true"/>
  <moldb-alogps-logs nil="true"/>
  <moldb-alogps-solubility nil="true"/>
  <kingdom>Organic compounds</kingdom>
  <superklass>Benzenoids</superklass>
  <klass>Benzene and substituted derivatives</klass>
  <subklass>Biphenyls and derivatives</subklass>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0116938</sync-id>
  <structure-inchikey>UPSAJZSSQKUOAT-UHFFFAOYSA-N</structure-inchikey>
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  <structure-indexed-at type="dateTime">2026-09-19T04:40:45Z</structure-indexed-at>
</compound>
