<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">342659</id>
  <title nil="true"/>
  <common-name>7-methoxy-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-methylchromen-4-one</common-name>
  <description>7-methoxy-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-methylchromen-4-one is a chemical compound with the formula C25H30N2O4. It has an average molecular weight of 422.50 g/mol.</description>
  <cas>69103-91-9</cas>
  <pubchem-id>50308</pubchem-id>
  <chemical-formula>C25H30N2O4</chemical-formula>
  <weight>422.5</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">2026-08-31T03:41:26Z</created-at>
  <updated-at type="dateTime">2026-08-31T03:41:26Z</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(OC2=C(C1=O)C=CC(=C2)OC)CCCN3CCN(CC3)C4=CC=CC=C4OC</moldb-smiles>
  <moldb-formula>C25H30N2O4</moldb-formula>
  <moldb-inchi>InChI=1S/C25H30N2O4/c1-18-22(31-24-17-19(29-2)10-11-20(24)25(18)28)9-6-12-26-13-15-27(16-14-26)21-7-4-5-8-23(21)30-3/h4-5,7-8,10-11,17H,6,9,12-16H2,1-3H3</moldb-inchi>
  <moldb-inchikey>XLYNVYYLQJMVFZ-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">422.2205574</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.1</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>CHEM338552</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>7-methoxy-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-methylchromen-4-one</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>CED0293045</sync-id>
  <structure-inchikey>XLYNVYYLQJMVFZ-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>2080000000000000000000000000000000000001000048000000000000002020000000000000000000030000020000000000000000000010040000000000000000000000000000006480000000010000020000000000000004000000000000004000000010000000000002010400000000000000000000000000004000020080000000000000400000000000050000000000100000000000010000000000000004000008000000200000000000000000a000000800080080000000000000000800000000010000000000000800002004000200000000010018800000000000000040000000010000001000000028000000000000000000</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���h���h���(���h��	h�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:42:14Z</structure-indexed-at>
</compound>
