339004 <common-name>7-(4-ethylphenyl)-6-(4-methoxyphenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione</common-name> <description>7-(4-ethylphenyl)-6-(4-methoxyphenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione is a chemical compound with the formula C24H23N5O3. It has an average molecular weight of 429.50 g/mol.</description> <cas>96885-25-5</cas> <pubchem-id>5048761</pubchem-id> <chemical-formula>C24H23N5O3</chemical-formula> <weight>429.5</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">2026-08-30T22:12:00Z</created-at> <updated-at type="dateTime">2026-08-30T22:12:00Z</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>CCC1=CC=C(C=C1)C2=CN3C4=C(N=C3N2C5=CC=C(C=C5)OC)N(C(=O)N(C4=O)C)C</moldb-smiles> <moldb-formula>C24H23N5O3</moldb-formula> <moldb-inchi>InChI=1S/C24H23N5O3/c1-5-15-6-8-16(9-7-15)19-14-28-20-21(26(2)24(31)27(3)22(20)30)25-23(28)29(19)17-10-12-18(32-4)13-11-17/h6-14H,5H2,1-4H3</moldb-inchi> <moldb-inchikey>AQYMTXFJRXPNCV-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">429.1800896</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.6</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>CHEM334897</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>7-(4-ethylphenyl)-6-(4-methoxyphenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-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>Imidazopyrimidines</klass> <subklass>Purines and purine derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0289430</sync-id> <structure-inchikey>AQYMTXFJRXPNCV-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>200000800000400000000040000000000000000000004000000000000002000220200000000100002000008000000000000001800000000480000000000000080000000000000000000020000000000100000200000000000010040000000000010040000000400000800000000120002000000000000000008000000040000000000000000000004000800000000000000000000000200000000000102000000000000000080004000000000082000000000000000000000080000000000000000000000000000000000000088000000000000220000000000100000040000001000040000000000000000000000040000040000000000000</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��� � h� h� �h���h�� h� �h���h��� ��h���h���h���h���h��� �����h���h���(���h���h���(���������h���h�� h���h���h�B������������ ��� � �� �������������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:39:37Z</structure-indexed-at> </compound>