<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">312938</id>
  <title nil="true"/>
  <common-name>5-[bis(prop-2-enyl)amino]-3,6-dimethyl-1-phenylpyrimidine-2,4-dione</common-name>
  <description>5-[bis(prop-2-enyl)amino]-3,6-dimethyl-1-phenylpyrimidine-2,4-dione is a chemical compound with the formula C18H21N3O2. It has an average molecular weight of 311.40 g/mol.</description>
  <cas>32150-62-2</cas>
  <pubchem-id>208430</pubchem-id>
  <chemical-formula>C18H21N3O2</chemical-formula>
  <weight>311.4</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">2026-08-29T09:39:37Z</created-at>
  <updated-at type="dateTime">2026-08-29T09:39:37Z</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(=O)N(C(=O)N1C2=CC=CC=C2)C)N(CC=C)CC=C</moldb-smiles>
  <moldb-formula>C18H21N3O2</moldb-formula>
  <moldb-inchi>InChI=1S/C18H21N3O2/c1-5-12-20(13-6-2)16-14(3)21(15-10-8-7-9-11-15)18(23)19(4)17(16)22/h5-11H,1-2,12-13H2,3-4H3</moldb-inchi>
  <moldb-inchikey>OXKMQABFDJFCKD-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">311.1633769</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.9</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>CHEM308831</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>5-[bis(prop-2-enyl)amino]-3,6-dimethyl-1-phenylpyrimidine-2,4-dione</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 nitrogen compounds</superklass>
  <klass>Organonitrogen compounds</klass>
  <subklass>Amines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0263861</sync-id>
  <structure-inchikey>OXKMQABFDJFCKD-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>100000000000200000800000000000000000000000004000000000000010000000000000000020000000000000000004000100000000000000000000000080000000000000080000000000000000000020000000000200000000000000000010000000000000000000000000004000000000000108000000008000000000000000004040000000800000000000004000000000000100000000000000200000000000000000400000000200080080000000000000000000000000000010001000000000000000000000000000040000000001000000002000000200020000000000000040000000000040000000000000000000000000000040000004000000</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��	 	
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�h���h��h��h������ ����������������������h��	h�B������������
���	����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:19:47Z</structure-indexed-at>
</compound>
