310362 <common-name>1-(4-bromophenyl)-2-(4-phenylpyrimidin-1-ium-1-yl)ethanone</common-name> <description>1-(4-bromophenyl)-2-(4-phenylpyrimidin-1-ium-1-yl)ethanone is a compound with the formula C18H14BrN2O+. It has an average molecular weight of 354.20 g/mol.</description> <cas>741625-52-5</cas> <pubchem-id>4621520</pubchem-id> <chemical-formula>C18H14BrN2O+</chemical-formula> <weight>354.2</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">2026-08-29T05:34:56Z</created-at> <updated-at type="dateTime">2026-08-29T05:34:56Z</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)C2=NC=[N+](C=C2)CC(=O)C3=CC=C(C=C3)Br</moldb-smiles> <moldb-formula>C18H14BrN2O+</moldb-formula> <moldb-inchi>InChI=1S/C18H14BrN2O/c19-16-8-6-15(7-9-16)18(22)12-21-11-10-17(20-13-21)14-4-2-1-3-5-14/h1-11,13H,12H2/q+1</moldb-inchi> <moldb-inchikey>JSTJTAGALVFUDS-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">353.02895</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.2</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>CHEM306255</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>1-(4-bromophenyl)-2-(4-phenylpyrimidin-1-ium-1-yl)ethanone</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>Organic oxygen compounds</superklass> <klass>Organooxygen compounds</klass> <subklass>Carbonyl compounds</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0261341</sync-id> <structure-inchikey>JSTJTAGALVFUDS-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000000000000440000000000000000000000000000000000000000000010000000002004000000000000000009000000000000000000000000000000000000000000000020000000000000000008808000000000000000010400000000000000000000000600000000000000000800001000000000000000000000800000000000010004800000000100000000000000000000000000000000000010000000084000000000000000080000000000000000000000000000000000000000200100004000800000044000000000000200000000000000002000000000000040000000000400000000000010000000000000000000</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�B�������������� �������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:17:49Z</structure-indexed-at> </compound>