323883 <common-name>7-(2-amino-1-morpholin-4-ylethyl)-8-benzyl-1,3-dimethylpurine-2,6-dione</common-name> <description>7-(2-amino-1-morpholin-4-ylethyl)-8-benzyl-1,3-dimethylpurine-2,6-dione is a chemical compound with the formula C20H26N6O3. It has an average molecular weight of 398.50 g/mol.</description> <cas nil="true"/> <pubchem-id>3048480</pubchem-id> <chemical-formula>C20H26N6O3</chemical-formula> <weight>398.5</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">2026-08-30T00:44:12Z</created-at> <updated-at type="dateTime">2026-08-30T00:44:12Z</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>CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CC3=CC=CC=C3)C(CN)N4CCOCC4</moldb-smiles> <moldb-formula>C20H26N6O3</moldb-formula> <moldb-inchi>InChI=1S/C20H26N6O3/c1-23-18-17(19(27)24(2)20(23)28)26(16(13-21)25-8-10-29-11-9-25)15(22-18)12-14-6-4-3-5-7-14/h3-7,16H,8-13,21H2,1-2H3</moldb-inchi> <moldb-inchikey>LSMSVLAIEJKPPY-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">398.2066387</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>0.3</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>CHEM319776</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-(2-amino-1-morpholin-4-ylethyl)-8-benzyl-1,3-dimethylpurine-2,6-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>CED0274546</sync-id> <structure-inchikey>LSMSVLAIEJKPPY-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>400000000000000000008000000000000000000000000800010000000000000000000000000000220000000000000020040080000000000000000000000004800010000000000800000000000000000000208002000000000000000000000000100000000000008000000002000000000000000201000200000004000000000080000000412000008000000000400040000010000001000000000000002040000000001100000000000000000810000400000200c000000000800000000000000000000000000000000000000000000008000000c000000000000220000000000000000000000001000040000010040000000000000000000000000000000000</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����B�������������� ��������������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:28:13Z</structure-indexed-at> </compound>