<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">302330</id>
  <title nil="true"/>
  <common-name>4-[4-chloro-3-(trifluoromethyl)phenyl]-n-(dimethylcarbamoyl)-n-methylpiperazine-1-carboxamide</common-name>
  <description>4-[4-chloro-3-(trifluoromethyl)phenyl]-n-(dimethylcarbamoyl)-n-methylpiperazine-1-carboxamide belongs to the piperazines, a subclass of diazinanes within the organic compounds. This organoheterocyclic compound has the formula C16H20ClF3N4O2 and an average molecular weight of 392.80 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>3066965</pubchem-id>
  <chemical-formula>C16H20ClF3N4O2</chemical-formula>
  <weight>392.8</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">2026-08-28T19:23:32Z</created-at>
  <updated-at type="dateTime">2026-08-28T19:23:32Z</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>CN(C)C(=O)N(C)C(=O)N1CCN(CC1)C2=CC(=C(C=C2)Cl)C(F)(F)F</moldb-smiles>
  <moldb-formula>C16H20ClF3N4O2</moldb-formula>
  <moldb-inchi>InChI=1S/C16H20ClF3N4O2/c1-21(2)14(25)22(3)15(26)24-8-6-23(7-9-24)11-4-5-13(17)12(10-11)16(18,19)20/h4-5,10H,6-9H2,1-3H3</moldb-inchi>
  <moldb-inchikey>ZUOBIFABXYECPN-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">392.1226881</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.6</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>CHEM298223</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-[4-chloro-3-(trifluoromethyl)phenyl]-n-(dimethylcarbamoyl)-n-methylpiperazine-1-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>Diazinanes</klass>
  <subklass>Piperazines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0253549</sync-id>
  <structure-inchikey>ZUOBIFABXYECPN-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>2000400000000000000000000000004000000200001000000000000000000002000000000100100001000000000000008000000000000000400000000000000000000420002000018000000000000000000000000000014000000000000000104000000000020100000000000000000000000040000040000000000000000000000000100000000000000000000000000010000000000000000000000000080000000000000000040000008000000800000000000000000004000000000000008400000014080000000000000200000000000000000040000000000040000000000400800000000000000000004000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������(�������`�������(�������(�������(�������`�������(�������(�������(�������`�������`�������(�������`�������`������@(������@h�������@(������@(������@h�������@h�������� ������ ����	� ����	� ����	� ������������� ��(��� ����� ��(��	 	
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  <structure-indexed-at type="dateTime">2026-09-19T05:11:47Z</structure-indexed-at>
</compound>
