316246 <common-name>3-[2-benzyl-5-(trifluoromethyl)benzimidazol-1-yl]butanoic acid</common-name> <description>3-[2-benzyl-5-(trifluoromethyl)benzimidazol-1-yl]butanoic acid is a chemical compound with the formula C19H17F3N2O2. It has an average molecular weight of 362.30 g/mol.</description> <cas>141245-96-7</cas> <pubchem-id>3072203</pubchem-id> <chemical-formula>C19H17F3N2O2</chemical-formula> <weight>362.3</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">2026-08-29T13:57:27Z</created-at> <updated-at type="dateTime">2026-08-29T13:57:27Z</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>CC(CC(=O)O)N1C2=C(C=C(C=C2)C(F)(F)F)N=C1CC3=CC=CC=C3</moldb-smiles> <moldb-formula>C19H17F3N2O2</moldb-formula> <moldb-inchi>InChI=1S/C19H17F3N2O2/c1-12(9-18(25)26)24-16-8-7-14(19(20,21)22)11-15(16)23-17(24)10-13-5-3-2-4-6-13/h2-8,11-12H,9-10H2,1H3,(H,25,26)</moldb-inchi> <moldb-inchikey>JXXFWRQATUUBNG-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">362.1242123</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.1</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>CHEM312139</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>3-[2-benzyl-5-(trifluoromethyl)benzimidazol-1-yl]butanoic acid</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>CED0267085</sync-id> <structure-inchikey>JXXFWRQATUUBNG-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000400000000800000002000000000000000010000000000000000400000001000000002000000000000002004000000000000004000000000000000100000000000000000000000000000000020000000000000000000000000000000000000014000800000000200100000000002000100000000000000000000000000000041200000804000000000040000000000000100000000000000080000002000000000000000000000080020000040020000040000000000000000200000000000000000200000000000000000480000000000000000400220000000000000000008000001000040000000000400800000000000000000000004000000</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�B����������� ���������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:22:21Z</structure-indexed-at> </compound>