<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">308233</id>
  <title nil="true"/>
  <common-name>1-[4-(3-chlorophenyl)piperazin-1-yl]-3-[(4-methyl-1,3-thiazol-5-yl)oxy]propan-2-ol</common-name>
  <description>1-[4-(3-chlorophenyl)piperazin-1-yl]-3-[(4-methyl-1,3-thiazol-5-yl)oxy]propan-2-ol belongs to the piperazines, a subclass of diazinanes within the organic compounds. This organoheterocyclic compound has the formula C17H22ClN3O2S and an average molecular weight of 367.90 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>3078095</pubchem-id>
  <chemical-formula>C17H22ClN3O2S</chemical-formula>
  <weight>367.9</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">2026-08-29T02:37:17Z</created-at>
  <updated-at type="dateTime">2026-08-29T02:37:17Z</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=C(SC=N1)OCC(CN2CCN(CC2)C3=CC(=CC=C3)Cl)O</moldb-smiles>
  <moldb-formula>C17H22ClN3O2S</moldb-formula>
  <moldb-inchi>InChI=1S/C17H22ClN3O2S/c1-13-17(24-12-19-13)23-11-16(22)10-20-5-7-21(8-6-20)15-4-2-3-14(18)9-15/h2-4,9,12,16,22H,5-8,10-11H2,1H3</moldb-inchi>
  <moldb-inchikey>HVYZRUNIUWUTCP-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">367.1121258</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.3</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>CHEM304126</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-[4-(3-chlorophenyl)piperazin-1-yl]-3-[(4-methyl-1,3-thiazol-5-yl)oxy]propan-2-ol</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>CED0259260</sync-id>
  <structure-inchikey>HVYZRUNIUWUTCP-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000020000020800800000200000000400400000000000080100080000000000000000000000000000000002000000100000000000000000000008000008000000000400000008400000000000020200010010100000000000000000000000000010000001000000000100000000000020108000000000000000000000001004040000000800000000000000000000000000081000000000000000000000000000000000000000000080000000000000000080000008040000800000000000001000000000000001000000000000010000000002000000200000000010000000040000000000040000000000020000000000000000000000000000200</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`������@(������@(������@(������@h�������@(�������(�������`�������`�������`������� ������`�������`�������(�������`�������`������@(������@h�������@(������@h�������@h�������@h�������� ������`�����������h���h���h���h��� �������	�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:16:11Z</structure-indexed-at>
</compound>
