<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">339655</id>
  <title nil="true"/>
  <common-name>(4-chlorophenyl)-[4-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperazin-1-yl]methanone</common-name>
  <description>(4-chlorophenyl)-[4-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperazin-1-yl]methanone is a chemical compound with the formula C24H28ClF3N4O. It has an average molecular weight of 481.00 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>3049834</pubchem-id>
  <chemical-formula>C24H28ClF3N4O</chemical-formula>
  <weight>481</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">2026-08-30T23:00:50Z</created-at>
  <updated-at type="dateTime">2026-08-30T23:00:50Z</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>C1CN(CCN1CCN2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl)C4=CC=CC(=C4)C(F)(F)F</moldb-smiles>
  <moldb-formula>C24H28ClF3N4O</moldb-formula>
  <moldb-inchi>InChI=1S/C24H28ClF3N4O/c25-21-6-4-19(5-7-21)23(33)32-16-12-30(13-17-32)9-8-29-10-14-31(15-11-29)22-3-1-2-20(18-22)24(26,27)28/h1-7,18H,8-17H2</moldb-inchi>
  <moldb-inchikey>MELKKLXEVBZVPV-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">480.1903737</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.3</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>CHEM335548</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-chlorophenyl)-[4-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperazin-1-yl]methanone</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>Diazinanes</klass>
  <subklass>Piperazines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0290073</sync-id>
  <structure-inchikey>MELKKLXEVBZVPV-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>2080000000200000000000000000000000008000000000000000000000000000000000000000000000010000000000000000000000c00000000000000040000000000000000000002000000001000000000000000000000000000001408000000000000010000000000002010200000000000000000000000100400002000080000000000000400000000000000000000000000008000000000000040000000000000008400000004000004004000000a000008900200000000000000004000000000000000000000010004000000000000200000000010000000040000000000040000000000400800000000000000000004040000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAhAAAAJAAAAIABBgBgAAAAAgIGAGAAAAAC
AgcAKAAAAAMDBgBgAAAAAgIGAGAAAAACAgcAIAAAAAMGAGAAAAACAgYAYAAA
AAICBwAgAAAAAwYAYAAAAAICBgBgAAAAAgIHACgAAAADAwYAYAAAAAICBgBg
AAAAAgIGACgAAAADBAgAKAAAAAMCBkAoAAAAAwQGQGgAAAADAwEGQGgAAAAD
AwEGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAREAIAAAAAEGQCgAAAADBAZA
aAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZAKAAAAAMEBkBoAAAAAwMBBgAg
AAAABAkAIAAAAAEJACAAAAABCQAgAAAAAQsAAQABAgACAwADBAAEBQAFBgAG
BwAHCAAICQAJCgAKCwALDAAMDQALDiAODygCDhAgEBFoDBESaAwSE2gMExRo
DBQVaAwTFgACFyAXGGgMGBloDBkaaAwaG2gMGxxoDBsdAB0eAB0fAB0gAAUA
AA0IABUQaAwcF2gMQgQAAAAGAAUEAwIBBgkKCwwNCAYREhMUFRAGGBkaGxwX
FwQAAAAAAAAAFg==
</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:40:06Z</structure-indexed-at>
</compound>
