<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">297579</id>
  <title nil="true"/>
  <common-name>6-methoxy-2-(2-piperidin-1-ylethylsulfanyl)-1,3-benzoxazole</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>26778</pubchem-id>
  <chemical-formula>C15H20N2O2S</chemical-formula>
  <weight>292.4</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">2026-08-28T13:48:11Z</created-at>
  <updated-at type="dateTime">2026-08-28T13:48:11Z</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>COC1=CC2=C(C=C1)N=C(O2)SCCN3CCCCC3</moldb-smiles>
  <moldb-formula>C15H20N2O2S</moldb-formula>
  <moldb-inchi>InChI=1S/C15H20N2O2S/c1-18-12-5-6-13-14(11-12)19-15(16-13)20-10-9-17-7-3-2-4-8-17/h5-6,11H,2-4,7-10H2,1H3</moldb-inchi>
  <moldb-inchikey>OLDDXIDORFQOPH-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">292.1245491</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.5</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>CHEM293472</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>6-methoxy-2-(2-piperidin-1-ylethylsulfanyl)-1,3-benzoxazole</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>Benzoxazoles</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0248957</sync-id>
  <structure-inchikey>OLDDXIDORFQOPH-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>2000000000000000000080000000080000000040000000000000080000000000000000000000000020000400000000200000000000000000000000000000000000000000000000000000000000000000000080000000010000020000000000000004400000000000004000000010000000000002010000004000000000000000080000004000000000400000000000400000000200000000800000000000000000000000000000000000000008000000000200000000000000a000000000000080240000000000000800100000000000000000000000000000000200008000010010800000000001000040080000000000000000000008000002000000000000</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�	
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	�����������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:08:26Z</structure-indexed-at>
</compound>
