<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">339049</id>
  <title nil="true"/>
  <common-name>1-[1-[5-chloro-2-(2-chlorophenyl)sulfanylphenyl]ethyl]-4-phenylpiperazine</common-name>
  <description>1-[1-[5-chloro-2-(2-chlorophenyl)sulfanylphenyl]ethyl]-4-phenylpiperazine is a chemical compound with the formula C24H24Cl2N2S. It has an average molecular weight of 443.40 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>3086916</pubchem-id>
  <chemical-formula>C24H24Cl2N2S</chemical-formula>
  <weight>443.4</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">2026-08-30T22:15:34Z</created-at>
  <updated-at type="dateTime">2026-08-30T22:15:34Z</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>CC(C1=C(C=CC(=C1)Cl)SC2=CC=CC=C2Cl)N3CCN(CC3)C4=CC=CC=C4</moldb-smiles>
  <moldb-formula>C24H24Cl2N2S</moldb-formula>
  <moldb-inchi>InChI=1S/C24H24Cl2N2S/c1-18(27-13-15-28(16-14-27)20-7-3-2-4-8-20)21-17-19(25)11-12-23(21)29-24-10-6-5-9-22(24)26/h2-12,17-18H,13-16H2,1H3</moldb-inchi>
  <moldb-inchikey>CVCPJBURRNAXFE-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">442.1037253</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>7.1</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>CHEM334942</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>1-[1-[5-chloro-2-(2-chlorophenyl)sulfanylphenyl]ethyl]-4-phenylpiperazine</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>CED0289474</sync-id>
  <structure-inchikey>CVCPJBURRNAXFE-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000000000000000800000000000400000000000080000400010000001000000000000000000002004004000100000000000000000000000000000000000080400000000000000000000000000000010000000000080000000000000000000080000000000000100800000000020100000000020000000000004040004040000000800000000000000000000000000100000200000000104000000000000000000000000000080000040000000000000000008000000800000000000000000000000000001000000000000010000002000000000200000000000008000040000000000040000000080000000000000000000000000000000100</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�����	�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:39:39Z</structure-indexed-at>
</compound>
