<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">339061</id>
  <title nil="true"/>
  <common-name>2-[4-(4-chlorophenyl)piperazin-1-yl]ethyl (e)-3-quinolin-4-ylprop-2-enoate</common-name>
  <description>2-[4-(4-chlorophenyl)piperazin-1-yl]ethyl (e)-3-quinolin-4-ylprop-2-enoate is a chemical compound with the formula C24H24ClN3O2. It has an average molecular weight of 421.90 g/mol.</description>
  <cas>4415-60-5</cas>
  <pubchem-id>6444451</pubchem-id>
  <chemical-formula>C24H24ClN3O2</chemical-formula>
  <weight>421.9</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">2026-08-30T22:16:29Z</created-at>
  <updated-at type="dateTime">2026-08-30T22:16:29Z</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(CCN1CCOC(=O)C=CC2=CC=NC3=CC=CC=C23)C4=CC=C(C=C4)Cl</moldb-smiles>
  <moldb-formula>C24H24ClN3O2</moldb-formula>
  <moldb-inchi>InChI=1S/C24H24ClN3O2/c25-20-6-8-21(9-7-20)28-15-13-27(14-16-28)17-18-30-24(29)10-5-19-11-12-26-23-4-2-1-3-22(19)23/h1-12H,13-18H2/b10-5+</moldb-inchi>
  <moldb-inchikey>WUCMLBDFUBJCTR-BJMVGYQFSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">421.1557047</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.7</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>CHEM334954</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>2-[4-(4-chlorophenyl)piperazin-1-yl]ethyl (e)-3-quinolin-4-ylprop-2-enoate</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>CED0289486</sync-id>
  <structure-inchikey>WUCMLBDFUBJCTR-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000100000000002180000000000000001000000080000000008000400000000000004000000000000000000000200000010000000000000000800000000000000410000040000000000000000400002000000001030000000000000000000000100001008000100000000000000000000002010000004000001000000000000000000002400080400000000000400000000000010000000000000000000000000000000000000004000008000004000000000008000000a000000800000000000000040008000000000004000000000010000000000000000200000000010000000040000000002040000000000400000000000200000000800000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAeAAAAIQAAAIABBgBgAAAAAgIGAGAAAAAC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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:39:39Z</structure-indexed-at>
</compound>
