<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">10157</id>
  <title nil="true"/>
  <common-name>1,4-Benzenedicarboxylic acid, 2,5-bis[(4-methylphenyl)amino]-</common-name>
  <description nil="true"/>
  <cas>10291-28-8</cas>
  <pubchem-id>82524</pubchem-id>
  <chemical-formula>C22H20N2O4</chemical-formula>
  <weight nil="true"/>
  <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">2016-05-19T02:57:19Z</created-at>
  <updated-at type="dateTime">2026-03-27T00:32:19Z</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(NC2=CC(C(O)=O)=C(NC3=CC=C(C)C=C3)C=C2C(O)=O)C=C1</moldb-smiles>
  <moldb-formula>C22H20N2O4</moldb-formula>
  <moldb-inchi>InChI=1S/C22H20N2O4/c1-13-3-7-15(8-4-13)23-19-11-18(22(27)28)20(12-17(19)21(25)26)24-16-9-5-14(2)6-10-16/h3-12,23-24H,1-2H3,(H,25,26)(H,27,28)</moldb-inchi>
  <moldb-inchikey>FVLUGNOOEZYDNV-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">376.412</moldb-average-mass>
  <moldb-mono-mass type="decimal">376.142307132</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>74476</chemspider-id>
  <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>CHEM009052</chemdb-id>
  <dsstox-id>DTXSID4065024</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00006027</susdat-id>
  <iupac>2,5-bis[(4-methylphenyl)amino]benzene-1,4-dicarboxylic acid</iupac>
</compound>
