334073 <common-name>2-[2-(5-chloro-2-oxo-3-phenylbenzimidazol-1-yl)ethyl]isoindole-1,3-dione</common-name> <description>2-[2-(5-chloro-2-oxo-3-phenylbenzimidazol-1-yl)ethyl]isoindole-1,3-dione is a chemical compound with the formula C23H16ClN3O3. It has an average molecular weight of 417.80 g/mol.</description> <cas>79759-56-1</cas> <pubchem-id>3061781</pubchem-id> <chemical-formula>C23H16ClN3O3</chemical-formula> <weight>417.8</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">2026-08-30T15:39:41Z</created-at> <updated-at type="dateTime">2026-08-30T15:39:41Z</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>C1=CC=C(C=C1)N2C3=C(C=CC(=C3)Cl)N(C2=O)CCN4C(=O)C5=CC=CC=C5C4=O</moldb-smiles> <moldb-formula>C23H16ClN3O3</moldb-formula> <moldb-inchi>InChI=1S/C23H16ClN3O3/c24-15-10-11-19-20(14-15)27(16-6-2-1-3-7-16)23(30)25(19)12-13-26-21(28)17-8-4-5-9-18(17)22(26)29/h1-11,14H,12-13H2</moldb-inchi> <moldb-inchikey>SAGMAVMKYHAMQL-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">417.0880191</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.8</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>CHEM329966</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-[2-(5-chloro-2-oxo-3-phenylbenzimidazol-1-yl)ethyl]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>Benzimidazoles</klass> <subklass>Phenylbenzimidazoles</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0284551</sync-id> <structure-inchikey>SAGMAVMKYHAMQL-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>8000000000400200000800000000000000000004400000000000080000000000000000000000020000000008000000006000000000000000000000000000000000000000000400000080000000080002020000000000000000000000000000010000000200080000000000000110000000000000100000000000080000020000000004000000100800000000000004000000000000100000000000000000000000000000000000000000000080000000000000000000000000000000000000000000000000000010000000000000000000010000000000000000200000000000000000040000000000040000400000080000000000000000044000004000000</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���h��� ��h�B������������ ���������������������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:36:01Z</structure-indexed-at> </compound>