347966 <common-name>2-[[1-[[4-(3-methylphenyl)piperazin-1-yl]methyl]benzimidazol-2-yl]methyl]isoindole-1,3-dione</common-name> <description>2-[[1-[[4-(3-methylphenyl)piperazin-1-yl]methyl]benzimidazol-2-yl]methyl]isoindole-1,3-dione is a chemical compound with the formula C28H27N5O2. It has an average molecular weight of 465.50 g/mol.</description> <cas>115410-51-0</cas> <pubchem-id>3087656</pubchem-id> <chemical-formula>C28H27N5O2</chemical-formula> <weight>465.5</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">2026-08-31T11:49:42Z</created-at> <updated-at type="dateTime">2026-08-31T11:49:42Z</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=CC(=CC=C1)N2CCN(CC2)CN3C4=CC=CC=C4N=C3CN5C(=O)C6=CC=CC=C6C5=O</moldb-smiles> <moldb-formula>C28H27N5O2</moldb-formula> <moldb-inchi>InChI=1S/C28H27N5O2/c1-20-7-6-8-21(17-20)31-15-13-30(14-16-31)19-33-25-12-5-4-11-24(25)29-26(33)18-32-27(34)22-9-2-3-10-23(22)28(32)35/h2-12,17H,13-16,18-19H2,1H3</moldb-inchi> <moldb-inchikey>RQRCJFYDZSZZQG-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">465.2164751</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4</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>CHEM343859</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-[[1-[[4-(3-methylphenyl)piperazin-1-yl]methyl]benzimidazol-2-yl]methyl]isoindole-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>Diazinanes</klass> <subklass>Piperazines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0298302</sync-id> <structure-inchikey>RQRCJFYDZSZZQG-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>80000000400000020800000000000000000008000000000000000000000000000000040000022000000008400002000000100000000000000000000008000100000000000000000080000000000002020000000010000000000000000000000000000200010000000000000110000000000020100000000000080000004000101004140008000804000000000000000000000000100000000000000000000040000000000000000000000080000000000000000000000008000000800000000000000000000000000000000000000001000000000002001800200040000010000000140000001000040000000008080000000000000000000000000000000</structure-fingerprint> 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