<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">314376</id>
  <title nil="true"/>
  <common-name>6,6-dimethyl-3-[2-(4-phenylpiperazin-1-yl)ethyl]-1,3-diazinane-2,4-dione</common-name>
  <description>6,6-dimethyl-3-[2-(4-phenylpiperazin-1-yl)ethyl]-1,3-diazinane-2,4-dione is a chemical compound with the formula C18H26N4O2. It has an average molecular weight of 330.40 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>3053463</pubchem-id>
  <chemical-formula>C18H26N4O2</chemical-formula>
  <weight>330.4</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">2026-08-29T11:25:50Z</created-at>
  <updated-at type="dateTime">2026-08-29T11:25:50Z</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(CC(=O)N(C(=O)N1)CCN2CCN(CC2)C3=CC=CC=C3)C</moldb-smiles>
  <moldb-formula>C18H26N4O2</moldb-formula>
  <moldb-inchi>InChI=1S/C18H26N4O2/c1-18(2)14-16(23)22(17(24)19-18)13-10-20-8-11-21(12-9-20)15-6-4-3-5-7-15/h3-7H,8-14H2,1-2H3,(H,19,24)</moldb-inchi>
  <moldb-inchikey>RTHRHDSBECPSPT-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">330.2055761</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.3</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>CHEM310269</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>6,6-dimethyl-3-[2-(4-phenylpiperazin-1-yl)ethyl]-1,3-diazinane-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>Organoheterocyclic compounds</superklass>
  <klass>Diazinanes</klass>
  <subklass>Piperazines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0265270</sync-id>
  <structure-inchikey>RTHRHDSBECPSPT-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>2080000000000000000000000000000000000000000000000000010000002000000000400000000400010000000001000000000000000000000000000000000008000000000000002000000001000000000000000000000000000200000000000000000000080000000802010800000080000000000000000000404800000080000020000000400000000000010000000000000000002000000000000000000000000008000004400000004000000000a000000800000000000000000000000000000000000000000000000000000000000200000000010000000040000000000040000400000004000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`������� ������`�������(�������(�������(�������(�������(�������h��������`�������`������� ������`�������`�������(�������`�������`������@(������@h�������@h�������@h�������@h�������@h��������`�����������������(��� �� ��(��� �	�	
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����������������� ��h���h���h���h���h������������h�B����������������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:20:49Z</structure-indexed-at>
</compound>
