<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">338611</id>
  <title nil="true"/>
  <common-name>[2-methoxy-4-[(e)-[[2-(4-methylanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] benzoate</common-name>
  <description>[2-methoxy-4-[(e)-[[2-(4-methylanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] benzoate is a chemical compound with the formula C24H21N3O5. It has an average molecular weight of 431.40 g/mol.</description>
  <cas>881461-30-9</cas>
  <pubchem-id>19659941</pubchem-id>
  <chemical-formula>C24H21N3O5</chemical-formula>
  <weight>431.4</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">2026-08-30T21:44:33Z</created-at>
  <updated-at type="dateTime">2026-08-30T21:44:33Z</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=CC=C(C=C1)NC(=O)C(=O)NN=CC2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3)OC</moldb-smiles>
  <moldb-formula>C24H21N3O5</moldb-formula>
  <moldb-inchi>InChI=1S/C24H21N3O5/c1-16-8-11-19(12-9-16)26-22(28)23(29)27-25-15-17-10-13-20(21(14-17)31-2)32-24(30)18-6-4-3-5-7-18/h3-15H,1-2H3,(H,26,28)(H,27,29)/b25-15+</moldb-inchi>
  <moldb-inchikey>LIMCTOLIAPSIDH-MFKUBSTISA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">431.1481208</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.2</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>CHEM334504</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>[2-methoxy-4-[(e)-[[2-(4-methylanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] benzoate</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>CED0289038</sync-id>
  <structure-inchikey>LIMCTOLIAPSIDH-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000200000000000040000000000100000800001000400000000000000602000000004000000004000000000000000000000000000000000000000000000000000002000000000020000000000300000004000000000000000000010000000050000080100000000000080200000000000000000000000000000040000400800100000000000090000000000100200000000400000000000000000000000000000000084000000000000000000000000000000000000080000000000100000000000000000000000000000000002040000200002000000000008108000000001040000000000480000000000020004000000000004000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ���������������� ���"���€���`������@(������@h�������@h�������@(������@h�������@h��������h��������(�������(�������(�������(�������h��������(�������h�������@(������@h�������@(������@(������@h�������@h��������(�������(�������(������@(������@h�������@h�������@h�������@h�������@h��������(�������`�����������h���h���h���h���h��� �� �	(��
 
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  <structure-indexed-at type="dateTime">2026-09-19T05:39:20Z</structure-indexed-at>
</compound>
