339335 <common-name>3-[2-(4-cyclohexylphenyl)-5-methylpyrrol-1-yl]benzoic acid</common-name> <description>3-[2-(4-cyclohexylphenyl)-5-methylpyrrol-1-yl]benzoic acid is a chemical compound with the formula C24H25NO2. It has an average molecular weight of 359.50 g/mol.</description> <cas>91306-88-6</cas> <pubchem-id>3021792</pubchem-id> <chemical-formula>C24H25NO2</chemical-formula> <weight>359.5</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">2026-08-30T22:37:40Z</created-at> <updated-at type="dateTime">2026-08-30T22:37:40Z</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=C(N1C2=CC=CC(=C2)C(=O)O)C3=CC=C(C=C3)C4CCCCC4</moldb-smiles> <moldb-formula>C24H25NO2</moldb-formula> <moldb-inchi>InChI=1S/C24H25NO2/c1-17-10-15-23(25(17)22-9-5-8-21(16-22)24(26)27)20-13-11-19(12-14-20)18-6-3-2-4-7-18/h5,8-16,18H,2-4,6-7H2,1H3,(H,26,27)</moldb-inchi> <moldb-inchikey>HJUKCXWWRYXJDM-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">359.188529</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>6.4</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>CHEM335228</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-(4-cyclohexylphenyl)-5-methylpyrrol-1-yl]benzoic 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>Pyrroles</klass> <subklass>Substituted pyrroles</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0289756</sync-id> <structure-inchikey>HJUKCXWWRYXJDM-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>20000000000000000000000200000000000000000000000000000000000000000000000000000000000000000000080014000000000000000080000000000000000000000000000000000000000000000020000000000000000000000000000000000004010000000000000000101020800000020100000000000000000000100801004040000000800000000000200002800001000000000000000040000001040000000004000000000000084000000000000006000000000000000000000000000000000000000000000004000000000000080000002000000200000000000010000040000000000040000000000400000100000000004040800000000000</structure-fingerprint> 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