<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">338223</id>
  <title nil="true"/>
  <common-name>[4-bromo-2-[(e)-[[2-(3,4-dimethylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2-chlorobenzoate</common-name>
  <description>[4-bromo-2-[(e)-[[2-(3,4-dimethylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2-chlorobenzoate is a chemical compound with the formula C24H20BrClN2O4. With an average molecular weight of 515.80 g/mol, [4-bromo-2-[(e)-[[2-(3,4-dimethylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2-chlorobenzoate is a heavy molecule.</description>
  <cas>339299-59-1</cas>
  <pubchem-id>9599500</pubchem-id>
  <chemical-formula>C24H20BrClN2O4</chemical-formula>
  <weight>515.8</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">2026-08-30T21:17:35Z</created-at>
  <updated-at type="dateTime">2026-08-30T21:17:35Z</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>CC1=C(C=C(C=C1)OCC(=O)NN=CC2=C(C=CC(=C2)Br)OC(=O)C3=CC=CC=C3Cl)C</moldb-smiles>
  <moldb-formula>C24H20BrClN2O4</moldb-formula>
  <moldb-inchi>InChI=1S/C24H20BrClN2O4/c1-15-7-9-19(11-16(15)2)31-14-23(29)28-27-13-17-12-18(25)8-10-22(17)32-24(30)20-5-3-4-6-21(20)26/h3-13H,14H2,1-2H3,(H,28,29)/b27-13+</moldb-inchi>
  <moldb-inchikey>QSTXEDFHUBVAGL-UVHMKAGCSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">514.0295</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>6.3</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
  <structure-image-file-name nil="true"/>
  <structure-image-content-type nil="true"/>
  <structure-image-file-size type="integer" nil="true"/>
  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM334116</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>[4-bromo-2-[(e)-[[2-(3,4-dimethylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2-chlorobenzoate</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>Phenylpropanoids and polyketides</superklass>
  <klass>Depsides and depsidones</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0288651</sync-id>
  <structure-inchikey>QSTXEDFHUBVAGL-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000000000800200000000000040000000000080400000000000000000000000000202200000000002000000000000000000000000000000000100000000000000400000000000000000000020400000000300000204800001000200000000010000000000400080100000000400080000000040020000000000000000002040000000800000000000000084000000000100000000000000000040000000080000000010000000080100000000000001080000000000040000000000000000000000000000000100000080000010100000002040000200000000000000000000000000001048010000000400100000000020000100080000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAgAAAAIgAAAIABBgBgAAAAAQMGQCgAAAAD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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:39:02Z</structure-indexed-at>
</compound>
