351552 <common-name>4-[n-[4-(n-(4-chlorobenzoyl)-2,6-dimethylanilino)butanoyl]-2,6-dimethylanilino]butanoic acid</common-name> <description>4-[n-[4-(n-(4-chlorobenzoyl)-2,6-dimethylanilino)butanoyl]-2,6-dimethylanilino]butanoic acid is a chemical compound with the formula C31H35ClN2O4. With an average molecular weight of 535.10 g/mol, 4-[n-[4-(n-(4-chlorobenzoyl)-2,6-dimethylanilino)butanoyl]-2,6-dimethylanilino]butanoic acid is a heavy molecule.</description> <cas>71455-66-8</cas> <pubchem-id>3054579</pubchem-id> <chemical-formula>C31H35ClN2O4</chemical-formula> <weight>535.1</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">2026-08-31T17:19:12Z</created-at> <updated-at type="dateTime">2026-08-31T17:19:12Z</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=C(C(=CC=C1)C)N(CCCC(=O)O)C(=O)CCCN(C2=C(C=CC=C2C)C)C(=O)C3=CC=C(C=C3)Cl</moldb-smiles> <moldb-formula>C31H35ClN2O4</moldb-formula> <moldb-inchi>InChI=1S/C31H35ClN2O4/c1-21-9-5-10-22(2)29(21)33(19-8-14-28(36)37)27(35)13-7-20-34(30-23(3)11-6-12-24(30)4)31(38)25-15-17-26(32)18-16-25/h5-6,9-12,15-18H,7-8,13-14,19-20H2,1-4H3,(H,36,37)</moldb-inchi> <moldb-inchikey>WOMFKQGDPWCASM-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">534.2285353</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>6.2</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>CHEM347445</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-[n-[4-(n-(4-chlorobenzoyl)-2,6-dimethylanilino)butanoyl]-2,6-dimethylanilino]butanoic 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>CED0301852</sync-id> <structure-inchikey>WOMFKQGDPWCASM-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>20040000000800000000000000000000000000000000080000000000000000000000000000000400002000004000100000000000000000000000000000000000000400000100000001000000020000000000000000000000000000000010000010080000000000000004000000000000000000000000000000000000001000040020000800002200000000000000000000000000400020000000000010000000000000000000000084100000000000000010000000000000000000000000008000000040000000000000000000010004000002000400200000000000000000000000000000040000000010400080001000000000001000000000000</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�B������������������� !"#$�����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:49:27Z</structure-indexed-at> </compound>