94742 <common-name>3,6-Bis[2-(methylthio)ethyl]piperazine-2,5-dione</common-name> <description>3,6-Bis[2-(methylthio)ethyl]piperazine-2,5-dione belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. This compound has the chemical formula C10H18N2O2S2 and an average molecular weight of 262.39 g/mol.</description> <cas>36963-02-7</cas> <pubchem-id>169842</pubchem-id> <chemical-formula>C10H18N2O2S2</chemical-formula> <weight nil="true"/> <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">2026-04-05T02:59:06Z</created-at> <updated-at type="dateTime">2026-04-05T02:59:06Z</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>CSCCC1N=C(O)C(CCSC)N=C1O</moldb-smiles> <moldb-formula>C10H18N2O2S2</moldb-formula> <moldb-inchi>InChI=1/C10H18N2O2S2/c1-15-5-3-7-9(13)12-8(4-6-16-2)10(14)11-7/h7-8H,3-6H2,1-2H3,(H,11,14)(H,12,13)</moldb-inchi> <moldb-inchikey>VSOISORJHNBTCV-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">262.39</moldb-average-mass> <moldb-mono-mass type="decimal">262.0809698</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <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>CHEM090635</chemdb-id> <dsstox-id>DTXSID70958140</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00056598</susdat-id> <iupac nil="true"/> <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">0</paper-count> <sync-id>CED0081861</sync-id> <structure-inchikey>VSOISORJHNBTCV-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>100000000000000000800000200800000000100000000000000000000000000000000000000000000000000000002000200000000001000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000010000008080000000000000000000000000000000000000000000100000000040000000000000000000000000000002000000000000000000000000000000000000000000000000080010000000000000000000000000000000000000000000000000002004000000000000000000000000000000000000000000000000000000000000000000000000000000000200000000400000000040000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`������� ������`�������`�������`�������(�������(�������h��������`�������`�������`������� ������`�������(�������(�������h������������������������(��� ���� � � ������ � �(��� ���B������� �������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:35:59Z</structure-indexed-at> </compound>