325675 <common-name>4-chloro-2-(3-methylanilino)-n-[(e)-(3-nitrophenyl)methylideneamino]benzamide</common-name> <description>4-chloro-2-(3-methylanilino)-n-[(e)-(3-nitrophenyl)methylideneamino]benzamide is a compound with the formula C21H17ClN4O3. It has an average molecular weight of 408.80 g/mol.</description> <cas>75412-51-0</cas> <pubchem-id>9588301</pubchem-id> <chemical-formula>C21H17ClN4O3</chemical-formula> <weight>408.8</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">2026-08-30T03:34:58Z</created-at> <updated-at type="dateTime">2026-08-30T03:34:58Z</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)NC2=C(C=CC(=C2)Cl)C(=O)NN=CC3=CC(=CC=C3)[N+](=O)[O-]</moldb-smiles> <moldb-formula>C21H17ClN4O3</moldb-formula> <moldb-inchi>InChI=1S/C21H17ClN4O3/c1-14-4-2-6-17(10-14)24-20-12-16(22)8-9-19(20)21(27)25-23-13-15-5-3-7-18(11-15)26(28)29/h2-13,24H,1H3,(H,25,27)/b23-13+</moldb-inchi> <moldb-inchikey>VKLGWXXZRLECGQ-YDZHTSKRSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">408.0989181</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.7</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>CHEM321568</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-chloro-2-(3-methylanilino)-n-[(e)-(3-nitrophenyl)methylideneamino]benzamide</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>CED0276304</sync-id> <structure-inchikey>VKLGWXXZRLECGQ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>1000000010000000000000000400000100000080000000000000000000000402004000000000000000080000000000000000000002100000000000000000400000000000002000000020000000000201001004000000400000000000010090000200000080100000000000080000000000000000000004000001000140000000800000200000000090000000001000000080000000000020000000000000000000400040080000000000000000000000000000000000000000000000000000000020000000000000000010000000002000000280000000000000400100000000001040000000000400000800001000000180000000004000</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������� *��������(������ *���ÿ��������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">2026-09-19T05:29:32Z</structure-indexed-at> </compound>