321377 <common-name>3-[4-[[3-[acetyl(ethyl)amino]-2,4,6-triiodobenzoyl]amino]phenyl]propanoic acid</common-name> <description>3-[4-[[3-[acetyl(ethyl)amino]-2,4,6-triiodobenzoyl]amino]phenyl]propanoic acid is a chemical compound with the formula C20H19I3N2O4. With an average molecular weight of 732.10 g/mol, 3-[4-[[3-[acetyl(ethyl)amino]-2,4,6-triiodobenzoyl]amino]phenyl]propanoic acid is a heavy molecule.</description> <cas>22708-45-8</cas> <pubchem-id>64843</pubchem-id> <chemical-formula>C20H19I3N2O4</chemical-formula> <weight>732.1</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">2026-08-29T20:49:26Z</created-at> <updated-at type="dateTime">2026-08-29T20:49:26Z</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>CCN(C1=C(C=C(C(=C1I)C(=O)NC2=CC=C(C=C2)CCC(=O)O)I)I)C(=O)C</moldb-smiles> <moldb-formula>C20H19I3N2O4</moldb-formula> <moldb-inchi>InChI=1S/C20H19I3N2O4/c1-3-25(11(2)26)19-15(22)10-14(21)17(18(19)23)20(29)24-13-7-4-12(5-8-13)6-9-16(27)28/h4-5,7-8,10H,3,6,9H2,1-2H3,(H,24,29)(H,27,28)</moldb-inchi> <moldb-inchikey>XWTKEJJYSRRQPC-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">731.8479</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>CHEM317270</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-[4-[[3-[acetyl(ethyl)amino]-2,4,6-triiodobenzoyl]amino]phenyl]propanoic 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>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Anilides</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0272098</sync-id> <structure-inchikey>XWTKEJJYSRRQPC-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>8000000000000000008000000001000000000000000000000000020002000000000000000000040001000000000000000000020000000000000000000000022000000000000000200400000000000000000000000000000100000100000000100040001040000000000008001000000000000000004000000500400004002008000000000000800000000000080000000010000000000100000000000000010000000800000000000000000000000000000000000000000000080800080000000000020000004010000000000000004002a0000000000000008000000000000040000000000400000000000000200000040000000000</structure-fingerprint> 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