304743 <common-name>2-(benzimidazol-2-ylidene)-2-(3-hydroxy-2h-isoindol-1-yl)acetonitrile</common-name> <description>2-(benzimidazol-2-ylidene)-2-(3-hydroxy-2h-isoindol-1-yl)acetonitrile belongs to the benzimidazoles, a class of organoheterocyclic compounds within the organic compounds. This compound has the chemical formula C17H10N4O and an average molecular weight of 286.29 g/mol.</description> <cas>52821-73-5</cas> <pubchem-id>135452468</pubchem-id> <chemical-formula>C17H10N4O</chemical-formula> <weight>286.29</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">2026-08-28T22:16:28Z</created-at> <updated-at type="dateTime">2026-08-28T22:16:28Z</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>C1=CC2=C(NC(=C2C=C1)O)C(=C3N=C4C=CC=CC4=N3)C#N</moldb-smiles> <moldb-formula>C17H10N4O</moldb-formula> <moldb-inchi>InChI=1S/C17H10N4O/c18-9-12(16-19-13-7-3-4-8-14(13)20-16)15-10-5-1-2-6-11(10)17(22)21-15/h1-8,21-22H</moldb-inchi> <moldb-inchikey>UFNJRLCGPFEFCI-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">286.085461</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>CHEM300636</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-(benzimidazol-2-ylidene)-2-(3-hydroxy-2h-isoindol-1-yl)acetonitrile</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 nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0255871</sync-id> <structure-inchikey>UFNJRLCGPFEFCI-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000001000000000000000000000000000001000004002020000000000000000000000000000000000000000000000000000000000000000000000024000100000000400000000000000200110000000000000000000000000000010000000004000000000000000000000000000000800000200000000000000000040100000000000000000000200000000000000000040000088000000000000000000000000000000000000000000000040000002000000000000200000000000000000000004200000200000000000000000000000040000000000000000010000400000000000040000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€��@h�������@h�������@(������@(������@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">2026-09-19T05:13:41Z</structure-indexed-at> </compound>