<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">299045</id>
  <title nil="true"/>
  <common-name>2-[4-(dibutylamino)-6-methylpyrimidin-2-yl]sulfanylacetohydrazide</common-name>
  <description>2-[4-(dibutylamino)-6-methylpyrimidin-2-yl]sulfanylacetohydrazide belongs to the aryl thioethers, a subclass of thioethers within the organic compounds. It has the chemical formula C15H27N5OS and an average molecular weight of 325.50 g/mol.</description>
  <cas>77940-24-0</cas>
  <pubchem-id>53836</pubchem-id>
  <chemical-formula>C15H27N5OS</chemical-formula>
  <weight>325.5</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">2026-08-28T15:27:06Z</created-at>
  <updated-at type="dateTime">2026-08-28T15:27:06Z</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>CCCCN(CCCC)C1=NC(=NC(=C1)C)SCC(=O)NN</moldb-smiles>
  <moldb-formula>C15H27N5OS</moldb-formula>
  <moldb-inchi>InChI=1S/C15H27N5OS/c1-4-6-8-20(9-7-5-2)13-10-12(3)17-15(18-13)22-11-14(21)19-16/h10H,4-9,11,16H2,1-3H3,(H,19,21)</moldb-inchi>
  <moldb-inchikey>KLGFJNJXNQWFKF-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">325.1936317</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3</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>CHEM294938</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-[4-(dibutylamino)-6-methylpyrimidin-2-yl]sulfanylacetohydrazide</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>Organosulfur compounds</superklass>
  <klass>Thioethers</klass>
  <subklass>Aryl thioethers</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0250363</sync-id>
  <structure-inchikey>KLGFJNJXNQWFKF-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000000000800000000800000000000000000000000000000000000000000002000000000004080000002000000000000000000000000000000000000000000000000000010000000000002020000000000000000002000000000000000021010200000000000200104000000000000000000000000000000000000000000040000002000000000000000080001000000000000000000000000000000000000000000000000000080000000000000000000004004000002000800000008000000000000000000000000000000001000400002010000000000000002000000000000801000040000000010600000001010000400000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>41000010810206008000010001082900008004000005200000b020400210000c5002005900800000000041000088008004200025808cb0090000643000a04000c6110400020004000090100009620000000401904221013240000422000088000c280406004002000400000054150201200280700109c0043118084002150002024000180ce080080c021200082c0008111c0812444034024400080000406080405300000010c00080000940016c25300aca0000884108401000020008400250001000c424400a02018000040401028005000000024840000d0800000800010000000810000100440000001201022000001000308042000e0000008058000426</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������(�������`�������`�������`�������`������@(������@(������@(������@(������@(������@h��������`������� ������`�������(�������(�������h��������`�������������������������������	 	
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  <structure-indexed-at type="dateTime">2026-09-19T05:09:29Z</structure-indexed-at>
</compound>
