331586 <common-name>2-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-4,9-dihydropyrido[3,4-b]indole-1,3-dione</common-name> <description>2-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-4,9-dihydropyrido[3,4-b]indole-1,3-dione is a chemical compound with the formula C22H24N6O2. It has an average molecular weight of 404.50 g/mol.</description> <cas>184691-45-0</cas> <pubchem-id>3075507</pubchem-id> <chemical-formula>C22H24N6O2</chemical-formula> <weight>404.5</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">2026-08-30T12:27:28Z</created-at> <updated-at type="dateTime">2026-08-30T12:27:28Z</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>C1CN(CCN1CCCN2C(=O)CC3=C(C2=O)NC4=CC=CC=C34)C5=NC=CC=N5</moldb-smiles> <moldb-formula>C22H24N6O2</moldb-formula> <moldb-inchi>InChI=1S/C22H24N6O2/c29-19-15-17-16-5-1-2-6-18(16)25-20(17)21(30)28(19)10-4-9-26-11-13-27(14-12-26)22-23-7-3-8-24-22/h1-3,5-8,25H,4,9-15H2</moldb-inchi> <moldb-inchikey>GTGDTJMORUCVMG-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">404.196074</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.9</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>CHEM327479</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>2-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-4,9-dihydropyrido[3,4-b]indole-1,3-dione</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>Indoles and derivatives</klass> <subklass>Pyridoindoles</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0282120</sync-id> <structure-inchikey>GTGDTJMORUCVMG-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>2080000000010000000010000000000000000000000000000000000000002000000000004000200000010000000000800800000000000000000000000000000008000000000000012400000000000000000000000000000000000208000000000000000001000000000002010000000000200000000000000200000000000080000020000000400000000000010000000000000080000001001000000000000004000008000000000000000018000200a000000800000000000008040000000000000000000000080000000000000000004200000001010000000000000040002040000000010000000800000000000400000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ��������������������"���€���`�������`�������(�������`�������`������� ������`�������`�������`�������(�������(�������(�������`������@(������@(�������(�������(������@8�������@(������@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">2026-09-19T05:34:02Z</structure-indexed-at> </compound>