<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">298240</id>
  <title nil="true"/>
  <common-name>Ethyl 4-[(4-methoxyphenyl)methyl]piperazine-1-carboxylate</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>782702</pubchem-id>
  <chemical-formula>C15H22N2O3</chemical-formula>
  <weight>278.35</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">2026-08-28T14:37:32Z</created-at>
  <updated-at type="dateTime">2026-08-28T14:37:32Z</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>CCOC(=O)N1CCN(CC1)CC2=CC=C(C=C2)OC</moldb-smiles>
  <moldb-formula>C15H22N2O3</moldb-formula>
  <moldb-inchi>InChI=1S/C15H22N2O3/c1-3-20-15(18)17-10-8-16(9-11-17)12-13-4-6-14(19-2)7-5-13/h4-7H,3,8-12H2,1-2H3</moldb-inchi>
  <moldb-inchikey>VUBGZIROYCJGOB-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">278.1630426</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.8</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>CHEM294133</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>Ethyl 4-[(4-methoxyphenyl)methyl]piperazine-1-carboxylate</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>CED0249597</sync-id>
  <structure-inchikey>VUBGZIROYCJGOB-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>20800000000000000010000000000000000000000000000000000002000200200002000000000000000000000000000000000000000000000000000000000080000000000000000020000000000100000200000000000000048000010000010040000000000000000000020100000000000000000000000000000040400000000000000000000000000000000000000000020000000000000000000000000000000000080000000000000000000000008000000000000080000000000004000000000000000000000010000000002000000220041000010000000000000000000040000000000400000000000000000000004000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������(�������(�������(�������(�������`�������`������� ������`�������`�������`������@(������@h�������@h�������@(������@h�������@h��������(�������`�������������� ��(��� ����������	�	
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	�������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:08:53Z</structure-indexed-at>
</compound>
