<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">334422</id>
  <title nil="true"/>
  <common-name>10-chloro-1-(3-methoxyazetidine-1-carbonyl)-3-phenylpyrido[2,1-a]phthalazin-4-one</common-name>
  <description>10-chloro-1-(3-methoxyazetidine-1-carbonyl)-3-phenylpyrido[2,1-a]phthalazin-4-one is a chemical compound with the formula C23H18ClN3O3. It has an average molecular weight of 419.90 g/mol.</description>
  <cas>110924-83-9</cas>
  <pubchem-id>3066687</pubchem-id>
  <chemical-formula>C23H18ClN3O3</chemical-formula>
  <weight>419.9</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">2026-08-30T16:07:01Z</created-at>
  <updated-at type="dateTime">2026-08-30T16:07:01Z</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>COC1CN(C1)C(=O)C2=C3C4=C(C=CC(=C4)Cl)C=NN3C(=O)C(=C2)C5=CC=CC=C5</moldb-smiles>
  <moldb-formula>C23H18ClN3O3</moldb-formula>
  <moldb-inchi>InChI=1S/C23H18ClN3O3/c1-30-17-12-26(13-17)22(28)20-10-19(14-5-3-2-4-6-14)23(29)27-21(20)18-9-16(24)8-7-15(18)11-25-27/h2-11,17H,12-13H2,1H3</moldb-inchi>
  <moldb-inchikey>UDAXRMZYQLFUEY-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">419.1036691</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.7</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>CHEM330315</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>10-chloro-1-(3-methoxyazetidine-1-carbonyl)-3-phenylpyrido[2,1-a]phthalazin-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>Pyridines and derivatives</klass>
  <subklass>Phenylpyridines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0284899</sync-id>
  <structure-inchikey>UDAXRMZYQLFUEY-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>1000000000000000000102000000001400000000100082060000000000000000001020000000008020002004000008000000000000000000000080000000000000400000000000000000000120000000000100000000009000000000000000010080000040000000100000000000020140000800000000000000100000000040000000800000000000000000800000000104000000400000010000000000000000000400040000080000000000000080000000000000008200000100000000000004000000000000000000000010000000000000000200000000000000000000000001000040000000000400000000000000001100004000200000</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��h��h���h������h���h���h���h���(���h���h��� ��h���h���h���h���h������h��	h��
h���h�B�������������
�����	
������	������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:36:17Z</structure-indexed-at>
</compound>
