<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">295612</id>
  <title nil="true"/>
  <common-name>6-imino-2-oxo-7-prop-2-enyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide</common-name>
  <description>6-imino-2-oxo-7-prop-2-enyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide belongs to the pyrido[2,3-d]pyrimidines, a subclass of pyridopyrimidines within the organic compounds. This organoheterocyclic compound has the formula C15H13N5O2 and an average molecular weight of 295.30 g/mol.</description>
  <cas>510761-21-4</cas>
  <pubchem-id>706399</pubchem-id>
  <chemical-formula>C15H13N5O2</chemical-formula>
  <weight>295.3</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">2026-08-28T11:38:05Z</created-at>
  <updated-at type="dateTime">2026-08-28T11:38:05Z</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>C=CCN1C2=C(C=C(C1=N)C(=O)N)C(=O)N3C=CC=CC3=N2</moldb-smiles>
  <moldb-formula>C15H13N5O2</moldb-formula>
  <moldb-inchi>InChI=1S/C15H13N5O2/c1-2-6-20-12(16)9(13(17)21)8-10-14(20)18-11-5-3-4-7-19(11)15(10)22/h2-5,7-8,16H,1,6H2,(H2,17,21)</moldb-inchi>
  <moldb-inchikey>QPLBQSDZGWXHEW-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">295.1069247</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>-0.2</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>CHEM291505</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-imino-2-oxo-7-prop-2-enyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide</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>Pyridopyrimidines</klass>
  <subklass>Pyrido[2,3-d]pyrimidines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0247048</sync-id>
  <structure-inchikey>QPLBQSDZGWXHEW-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>10000000000000010000800000000000000801000000000000000000000000000000000000000420000001000000002080000000000000000000000000000080000000000000000000000080000140000020000000000200000000000000000000000000210010000000000000100000000000000108000000000000000100004000000000000000800400000006000000001000000100000000000000000000000000000000000000048200080000000000000000000000000000010000000000100000000000000000800000040000000000908000000000000200000000000000000800000001000040000080000400000000000040000100000000000000</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���h���h���h���h���h�B����������������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:07:04Z</structure-indexed-at>
</compound>
