297440 <common-name>3,5-dibromo-n-[[(2s)-1-ethylpyrrolidin-2-yl]methyl]-2-hydroxy-6-methoxybenzamide</common-name> <description>3,5-dibromo-n-[[(2s)-1-ethylpyrrolidin-2-yl]methyl]-2-hydroxy-6-methoxybenzamide belongs to the benzoic acids and derivatives, a subclass of benzene and substituted derivatives within the organic compounds. It is categorized under the benzenoids superclass. This compound has the formula C15H20Br2N2O3 and an average molecular weight of 436.14 g/mol.</description> <cas nil="true"/> <pubchem-id>3033771</pubchem-id> <chemical-formula>C15H20Br2N2O3</chemical-formula> <weight>436.14</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">2026-08-28T13:40:13Z</created-at> <updated-at type="dateTime">2026-08-28T13:40:13Z</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>CCN1CCCC1CNC(=O)C2=C(C(=CC(=C2OC)Br)Br)O</moldb-smiles> <moldb-formula>C15H20Br2N2O3</moldb-formula> <moldb-inchi>InChI=1S/C15H20Br2N2O3/c1-3-19-6-4-5-9(19)8-18-15(21)12-13(20)10(16)7-11(17)14(12)22-2/h7,9,20H,3-6,8H2,1-2H3,(H,18,21)/t9-/m0/s1</moldb-inchi> <moldb-inchikey>JNFBCMWINGLNPB-VIFPVBQESA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">433.98407</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3</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>CHEM293333</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>3,5-dibromo-n-[[(2s)-1-ethylpyrrolidin-2-yl]methyl]-2-hydroxy-6-methoxybenzamide</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>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Benzoic acids and derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0248823</sync-id> <structure-inchikey>JNFBCMWINGLNPB-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>200000000000800000000000000000000000000004200000000000000008000002000000000400000000000000020000000000020000000002000000000000000000001000200000000000000020000000000100000000800000000000000000010000004040000000100000000000020100040000000000204000100800000040000000000000000000000080000000000000000000000000000000000000000004000020000100080000000000004000000000408020000000000080008000000000012800000100000000000000000800200000000000000000000000000000000000000040000000000400000000000000000100000002000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAWAAAAFwAAAIABBgBgAAAAAQMGAGAAAAAC AgcAIAAAAAMGAGAAAAACAgYAYAAAAAICBgBgAAAAAgIGAGAAAAADAQYAYAAA AAICBwBoAAAAAwIBBgAoAAAAAwQIACgAAAADAgZAKAAAAAMEBkAoAAAAAwQG QCgAAAADBAZAaAAAAAMDAQZAKAAAAAMEBkAoAAAAAwQIACgAAAADAgYAYAAA AAEDIwAgAAAAASMAIAAAAAEIAGgAAAADAQELAAEAAQIAAgMAAwQABAUABQYA BgcABwgACAkgCQooAgkLIAsMaAwMDWgMDQ5oDA4PaAwPEGgMEBEgERIADxMA DRQADBUgBgIAEAtoDEICAAAABQIDBAUGBgwNDg8QCxcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:08:20Z</structure-indexed-at> </compound>