<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">317030</id>
  <title nil="true"/>
  <common-name>N-(4-bromophenyl)-n'-[(e)-1-(4-methylphenyl)ethylideneamino]butanediamide</common-name>
  <description>N-(4-bromophenyl)-n'-[(e)-1-(4-methylphenyl)ethylideneamino]butanediamide is a compound with the formula C19H20BrN3O2. It has an average molecular weight of 402.30 g/mol.</description>
  <cas>302910-48-1</cas>
  <pubchem-id>7346990</pubchem-id>
  <chemical-formula>C19H20BrN3O2</chemical-formula>
  <weight>402.3</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">2026-08-29T14:58:38Z</created-at>
  <updated-at type="dateTime">2026-08-29T14:58:38Z</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)CCC(=O)NC2=CC=C(C=C2)Br)C</moldb-smiles>
  <moldb-formula>C19H20BrN3O2</moldb-formula>
  <moldb-inchi>InChI=1S/C19H20BrN3O2/c1-13-3-5-15(6-4-13)14(2)22-23-19(25)12-11-18(24)21-17-9-7-16(20)8-10-17/h3-10H,11-12H2,1-2H3,(H,21,24)(H,23,25)/b22-14+</moldb-inchi>
  <moldb-inchikey>ZGNKDPBKMNGCSY-HYARGMPZSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">401.07389</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.2</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>CHEM312923</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-(4-bromophenyl)-n'-[(e)-1-(4-methylphenyl)ethylideneamino]butanediamide</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>Anilides</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0267860</sync-id>
  <structure-inchikey>ZGNKDPBKMNGCSY-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>20000040000000008000000000000000000000000001000000000010000000000000000000020000000000000000000000000000000000000000000000000000000000000000000000000000000000200000000000080000048000000000000000000100000000900000000000000404000000080000000000000400004000000000400004000000000000000000840000000000000000000001000000000000000000000000000000000a4000000000000000000000000000000000000000000008000000000000000100004000000000004000002000000210000000000000008100000000000040000000000480000000000000008000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAZAAAAGgAAAIABBgBgAAAAAQMGQCgAAAAD
BAZAaAAAAAMDAQZAaAAAAAMDAQZAKAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMB
BgAoAAAAAwQHACgAAAADAwcAaAAAAAMCAQYAKAAAAAMECAAoAAAAAwIGAGAA
AAACAgYAYAAAAAICBgAoAAAAAwQIACgAAAADAgcAaAAAAAMCAQZAKAAAAAME
BkBoAAAAAwMBBkBoAAAAAwMBBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEj
ACAAAAABBgBgAAAAAQMLAAEAAQJoDAIDaAwDBGgMBAVoDAUGaAwEByAHCCgC
CAkgCQogCgsoAgoMAAwNAA0OAA4PKAIOECAQESAREmgMEhNoDBMUaAwUFWgM
FRZoDBQXAAcYAAYBaAwWEWgMQgIAAAAGAQYFBAMCBhITFBUWERcEAAAAAAAA
ABY=
</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:22:57Z</structure-indexed-at>
</compound>
