345956 <common-name>[4-[(e)-[[2-(4-methylanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] naphthalene-1-carboxylate</common-name> <description>[4-[(e)-[[2-(4-methylanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] naphthalene-1-carboxylate is a chemical compound with the formula C27H21N3O4. It has an average molecular weight of 451.50 g/mol.</description> <cas nil="true"/> <pubchem-id>9687657</pubchem-id> <chemical-formula>C27H21N3O4</chemical-formula> <weight>451.5</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">2026-08-31T09:06:55Z</created-at> <updated-at type="dateTime">2026-08-31T09:06:55Z</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(C=C1)NC(=O)C(=O)NN=CC2=CC=C(C=C2)OC(=O)C3=CC=CC4=CC=CC=C43</moldb-smiles> <moldb-formula>C27H21N3O4</moldb-formula> <moldb-inchi>InChI=1S/C27H21N3O4/c1-18-9-13-21(14-10-18)29-25(31)26(32)30-28-17-19-11-15-22(16-12-19)34-27(33)24-8-4-6-20-5-2-3-7-23(20)24/h2-17H,1H3,(H,29,31)(H,30,32)/b28-17+</moldb-inchi> <moldb-inchikey>REFIDENGCQPRTK-OGLMXYFKSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">451.1532062</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.5</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>CHEM341849</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>[4-[(e)-[[2-(4-methylanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] naphthalene-1-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>Benzenoids</superklass> <klass>Naphthalenes</klass> <subklass>Naphthalenecarboxylic acids and derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0296310</sync-id> <structure-inchikey>REFIDENGCQPRTK-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>400000000000000000000000000000400000004001000000000010000000020000000004022000000040000000000000000000000000000000000000000000000000000000000000000000000000200000000003000002040000000000000000004100000000100000a0000000000000080000000000000000000000000001000040000401800180000000000080000000000100200000000000000000000000000000000000040000080000000000000003000000000000000000000000000000040100000000000000000080000000000000002040000200002000000000008100000001001040000000000480000000000000000100000000004000</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���h���h���h��� �� ��(��� ��h���h���h���h���h���h���h�� h� !h���h���h�!�h�!�h�B�����������������������!����� !�����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:44:50Z</structure-indexed-at> </compound>