345954 <common-name>[1-[(e)-[(2-anilino-2-oxoacetyl)hydrazinylidene]methyl]naphthalen-2-yl] 3-methylbenzoate</common-name> <description>[1-[(e)-[(2-anilino-2-oxoacetyl)hydrazinylidene]methyl]naphthalen-2-yl] 3-methylbenzoate 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>9682511</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">2026-08-31T09:06:41Z</created-at> <updated-at type="dateTime">2026-08-31T09:06:41Z</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(=CC=C1)C(=O)OC2=C(C3=CC=CC=C3C=C2)C=NNC(=O)C(=O)NC4=CC=CC=C4</moldb-smiles> <moldb-formula>C27H21N3O4</moldb-formula> <moldb-inchi>InChI=1S/C27H21N3O4/c1-18-8-7-10-20(16-18)27(33)34-24-15-14-19-9-5-6-13-22(19)23(24)17-28-30-26(32)25(31)29-21-11-3-2-4-12-21/h2-17H,1H3,(H,29,31)(H,30,32)/b28-17+</moldb-inchi> <moldb-inchikey>GZRJTNRVNIRBGN-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>CHEM341847</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>[1-[(e)-[(2-anilino-2-oxoacetyl)hydrazinylidene]methyl]naphthalen-2-yl] 3-methylbenzoate</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>Organic acids and derivatives</superklass> <klass>Carboxylic acids and derivatives</klass> <subklass>Amino acids, peptides, and analogues</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0296308</sync-id> <structure-inchikey>GZRJTNRVNIRBGN-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>200000000000040000000000100100800000000000000000000000202000000024000000004000000000040000000040000000000000000000000000000000000000000000020000000000301000004000000000000000000010000000400000080100000000000080000000000000000000004000001000140000401800180000000000080000000000100200000000000000000000000000200000000040000086000000000000000000000000000008000000000000000040100000000000000000000000000000000002040000200002000000000008100000001001040000000000400000000000020004000000000000000</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>