333672 <common-name>[2-[5-[[2-[diethyl(methyl)azaniumyl]acetyl]amino]-2,4-dimethylanilino]-2-oxoethyl]-diethyl-methylazanium</common-name> <description>[2-[5-[[2-[diethyl(methyl)azaniumyl]acetyl]amino]-2,4-dimethylanilino]-2-oxoethyl]-diethyl-methylazanium is a compound with the formula C22H40N4O2+2. It has an average molecular weight of 392.60 g/mol.</description> <cas nil="true"/> <pubchem-id>57871</pubchem-id> <chemical-formula>C22H40N4O2+2</chemical-formula> <weight>392.6</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">2026-08-30T15:11:43Z</created-at> <updated-at type="dateTime">2026-08-30T15:11:43Z</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>CC[N+](C)(CC)CC(=O)NC1=CC(=C(C=C1C)C)NC(=O)C[N+](C)(CC)CC</moldb-smiles> <moldb-formula>C22H40N4O2+2</moldb-formula> <moldb-inchi>InChI=1S/C22H38N4O2/c1-9-25(7,10-2)15-21(27)23-19-14-20(18(6)13-17(19)5)24-22(28)16-26(8,11-3)12-4/h13-14H,9-12,15-16H2,1-8H3/p+2</moldb-inchi> <moldb-inchikey>OIWOFUUOXHRWJM-UHFFFAOYSA-P</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">392.3151265</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.6</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>CHEM329565</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>[2-[5-[[2-[diethyl(methyl)azaniumyl]acetyl]amino]-2,4-dimethylanilino]-2-oxoethyl]-diethyl-methylazanium</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>CED0284152</sync-id> <structure-inchikey>OIWOFUUOXHRWJM-UHFFFAOYSA-P</structure-inchikey> <structure-fingerprint>4000000000800000000800002000000000000000000000000000000000000002000000000000000000000000000002000000000000000200000000000000000000000000000000000008000020000000000000000000000000000000000000010000000000000000100000000000000000000000008000000000000000010040000000000000000000000080000000000000000080000000000000000000000000000000000000080100200000000020000000000000000000000000000000000000000000000040000000000000080000002000000000000000000002008000000000000041000000000400000008000000000000000000000000</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�B����� �� ������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:35:43Z</structure-indexed-at> </compound>