365718 <common-name>1-(4-methyl-1,4-diazepan-1-yl)-2-methylsulfanylethanone</common-name> <description>1-(4-methyl-1,4-diazepan-1-yl)-2-methylsulfanylethanone is a compound with the formula C9H18N2OS. It has an average molecular weight of 202.32 g/mol.</description> <cas>1864320-37-5</cas> <pubchem-id>131108599</pubchem-id> <chemical-formula>C9H18N2OS</chemical-formula> <weight>202.32</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">2026-09-01T16:29:25Z</created-at> <updated-at type="dateTime">2026-09-01T16:29:25Z</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>CN1CCCN(CC1)C(=O)CSC</moldb-smiles> <moldb-formula>C9H18N2OS</moldb-formula> <moldb-inchi>InChI=1S/C9H18N2OS/c1-10-4-3-5-11(7-6-10)9(12)8-13-2/h3-8H2,1-2H3</moldb-inchi> <moldb-inchikey>BXGSKGHOZCBBEI-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">202.1139844</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>0.6</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>CHEM361611</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-(4-methyl-1,4-diazepan-1-yl)-2-methylsulfanylethanone</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 nil="true"/> <superklass nil="true"/> <klass nil="true"/> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0315666</sync-id> <structure-inchikey>BXGSKGHOZCBBEI-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>20000000000000000800000000800000000000000000000010000000000000000000000000000000000000000400000200000000000000000000000000000000000000000000000000000000000000020000000000000000000000000008000000000010000002000000000000000000000020100000000000000000040000800000040000010000000000000004000000000000000000000080000000000000000000000000202000000080000000000000000000000008000000000000000000000000004000000000000000000000000000000000000000000000000000000000000000000000000000000000400000200010000000000004000000000</structure-fingerprint> <structure-pattern-fingerprint>8102040000000000010820000000000000050000002000400200000c4000005000800000000001000080000004200001808c10010000443000a0000084110000000000000080100000620000000000004000003200000420000008000c200000004002000000000050100000200080100101c004311800000010000200400018044002000c0002000808000810040002444010020000080000004000404300000000400000000900042c211002c0000000010800000000000040020000100004240000000080000400010200000000000000400000000000080000000000080000000040000000004000200000100010004000000000008050000006</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ���������������� ��� ���€���`������� ������`�������`�������`�������(�������`�������`�������(�������(�������`������� ������`����������������������������� � (�� � ��������B����������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T06:01:45Z</structure-indexed-at> </compound>