<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">341572</id>
  <title nil="true"/>
  <common-name>N-[(e)-(4-methylphenyl)methylideneamino]-3-(4-phenylmethoxyphenyl)-1h-pyrazole-5-carboxamide</common-name>
  <description>N-[(e)-(4-methylphenyl)methylideneamino]-3-(4-phenylmethoxyphenyl)-1h-pyrazole-5-carboxamide is a chemical compound with the formula C25H22N4O2. It has an average molecular weight of 410.50 g/mol.</description>
  <cas>303106-09-4</cas>
  <pubchem-id>9679514</pubchem-id>
  <chemical-formula>C25H22N4O2</chemical-formula>
  <weight>410.5</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">2026-08-31T02:06:11Z</created-at>
  <updated-at type="dateTime">2026-08-31T02:06:11Z</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)C=NNC(=O)C2=CC(=NN2)C3=CC=C(C=C3)OCC4=CC=CC=C4</moldb-smiles>
  <moldb-formula>C25H22N4O2</moldb-formula>
  <moldb-inchi>InChI=1S/C25H22N4O2/c1-18-7-9-19(10-8-18)16-26-29-25(30)24-15-23(27-28-24)21-11-13-22(14-12-21)31-17-20-5-3-2-4-6-20/h2-16H,17H2,1H3,(H,27,28)(H,29,30)/b26-16+</moldb-inchi>
  <moldb-inchikey>QMLRRZXQQCZLDN-WGOQTCKBSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">410.174276</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.9</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>CHEM337465</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>N-[(e)-(4-methylphenyl)methylideneamino]-3-(4-phenylmethoxyphenyl)-1h-pyrazole-5-carboxamide</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>Organoheterocyclic compounds</superklass>
  <klass>Azoles</klass>
  <subklass>Pyrazoles</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0291970</sync-id>
  <structure-inchikey>QMLRRZXQQCZLDN-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000020800002100000000100000000000000000000001000000002000000000402200000000000002024000000000000000000000002000000000000000000000000000100000000000022000000000300000204000040000000000000010000000000000080100000800100080000000000000800000000000000000040200000800000200000000080800000000100000000000000000000000000000000000000000000080000000000000000080000000200000000000000000000000000000000000000000000000400000000002000000220000000000000000100000000001040000000000480000000000010000080080000004020</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ��������������������"���€���`������@(������@h�������@h�������@(������@h�������@h��������h��������(�������h��������(�������(������@(������@h�������@(������@(������@8�������@(������@h�������@h�������@(������@h�������@h��������(�������`������@(������@h�������@h�������@h�������@h�������@h������������h���h���h���h���h��� ��(��	 	
 
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  <structure-indexed-at type="dateTime">2026-09-19T05:41:29Z</structure-indexed-at>
</compound>
