347948 <common-name>Ethyl 2-[(3e)-2-(4-ethoxy-3-methoxyphenyl)-3-[(3-fluoro-4-methylphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate</common-name> <description>Ethyl 2-[(3e)-2-(4-ethoxy-3-methoxyphenyl)-3-[(3-fluoro-4-methylphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate is a chemical compound with the formula C28H27FN2O7S. With an average molecular weight of 554.60 g/mol, Ethyl 2-[(3e)-2-(4-ethoxy-3-methoxyphenyl)-3-[(3-fluoro-4-methylphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate is a heavy molecule.</description> <cas nil="true"/> <pubchem-id>5900692</pubchem-id> <chemical-formula>C28H27FN2O7S</chemical-formula> <weight>554.6</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">2026-08-31T11:48:28Z</created-at> <updated-at type="dateTime">2026-08-31T11:48:28Z</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>CCOC1=C(C=C(C=C1)C2C(=C(C3=CC(=C(C=C3)C)F)O)C(=O)C(=O)N2C4=NC(=C(S4)C(=O)OCC)C)OC</moldb-smiles> <moldb-formula>C28H27FN2O7S</moldb-formula> <moldb-inchi>InChI=1S/C28H27FN2O7S/c1-6-37-19-11-10-16(13-20(19)36-5)22-21(23(32)17-9-8-14(3)18(29)12-17)24(33)26(34)31(22)28-30-15(4)25(39-28)27(35)38-7-2/h8-13,22,32H,6-7H2,1-5H3/b23-21+</moldb-inchi> <moldb-inchikey>AEBVRDYQGNCHNB-XTQSDGFTSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">554.1523005</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.6</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>CHEM343841</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>Ethyl 2-[(3e)-2-(4-ethoxy-3-methoxyphenyl)-3-[(3-fluoro-4-methylphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate</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>Pyrrolidines</klass> <subklass>Phenylpyrrolidines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0298284</sync-id> <structure-inchikey>AEBVRDYQGNCHNB-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>400800800a00000000000050002010000000000000100400400000000002000020000000000000002004008010004000000000010000000000000000000000000000020000000000000020000010000110000000000000010000041000010000000440000000110000000000000100000000000000001000101020000040000000000000440000000000000000000000000000020420000101000000000000000000008000084100000008100000080000080000000000000080000040000000004000000000000000000000104000002000000200000000000010000000008001000040000000000420800000000020040000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAnAAAAKgAAAIABBgBgAAAAAQMGAGAAAAAC AggAKAAAAAMCBkAoAAAAAwQGQCgAAAADBAZAaAAAAAMDAQZAKAAAAAMEBkBo AAAAAwMBBkBoAAAAAwMBBgBgAAAAAwEGACgAAAADBAYAKAAAAAMEBkAoAAAA AwQGQGgAAAADAwEGQCgAAAADBAZAKAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMB BgBgAAAAAQMJACAAAAABCABoAAAAAwEBBgAoAAAAAwQIACgAAAADAgYAKAAA AAMECAAoAAAAAwIHACgAAAADAwZAKAAAAAMEB0AoAAAAAwMGQCgAAAADBAZA KAAAAAMEEEAoAAAAAwIGACgAAAADBAgAKAAAAAMCCAAoAAAAAwIGAGAAAAAC AgYAYAAAAAEDBgBgAAAAAQMIACgAAAADAgYAYAAAAAEDCwABAAECAAIDIAME aAwEBWgMBQZoDAYHaAwHCGgMBgkACQoACgsoAgsMIAwNaAwNDmgMDg9oDA8Q aAwQEWgMDxIADhMACxQgChUgFRYoAhUXIBcYKAIXGSAZGiAaG2gMGxxoDBwd aAwdHmgMHR8gHyAoAh8hICEiACIjABwkAAQlICUmAAgDaAwZCQARDGgMHhpo DEIEAAAABgMIBwYFBAYNDg8QEQwFFQoJGRcFGxoeHRwXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:46:29Z</structure-indexed-at> </compound>