332389 <common-name>6-[4-(1-benzofuran-2-ylmethyl)piperazin-1-yl]-2-n,4-n-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine</common-name> <description>6-[4-(1-benzofuran-2-ylmethyl)piperazin-1-yl]-2-n,4-n-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine is a chemical compound with the formula C22H27N7O. It has an average molecular weight of 405.50 g/mol.</description> <cas>87813-68-1</cas> <pubchem-id>3071355</pubchem-id> <chemical-formula>C22H27N7O</chemical-formula> <weight>405.5</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">2026-08-30T13:33:57Z</created-at> <updated-at type="dateTime">2026-08-30T13:33:57Z</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=CCNC1=NC(=NC(=N1)N2CCN(CC2)CC3=CC4=CC=CC=C4O3)NCC=C</moldb-smiles> <moldb-formula>C22H27N7O</moldb-formula> <moldb-inchi>InChI=1S/C22H27N7O/c1-3-9-23-20-25-21(24-10-4-2)27-22(26-20)29-13-11-28(12-14-29)16-18-15-17-7-5-6-8-19(17)30-18/h3-8,15H,1-2,9-14,16H2,(H2,23,24,25,26,27)</moldb-inchi> <moldb-inchikey>WJHIOLCCKAPEAS-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">405.2277085</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.1</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>CHEM328282</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-[4-(1-benzofuran-2-ylmethyl)piperazin-1-yl]-2-n,4-n-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine</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>CED0282907</sync-id> <structure-inchikey>WJHIOLCCKAPEAS-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>80020800000000000000000000000000000000000000000000000000000000000000000000000002000000100000000000000000000000000000000000000000000000001000000000000800000000200000000000000000000008000000000800000000100100000000000020108000000000100000200000000000000000401800000000080000080000000800100000000000000800000000000000000000000000200080000000080000000000400008000000800000000000000000200000800000000040000080000000000000000000200040000010000800000000001000040000080009000020001004000000000000000000000</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�B������ ������� �� �����������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:34:39Z</structure-indexed-at> </compound>