281153 <common-name>3-[(methylaminomethylamino)methyl]quinazolin-4-one</common-name> <description>3-[(methylaminomethylamino)methyl]quinazolin-4-one belongs to the benzodiazines, a subclass of diazanaphthalenes within the organic compounds. This organoheterocyclic compound has the formula C11H14N4O and an average molecular weight of 218.26 g/mol.</description> <cas nil="true"/> <pubchem-id>63873</pubchem-id> <chemical-formula>C11H14N4O</chemical-formula> <weight>218.26</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">2026-08-26T21:06:23Z</created-at> <updated-at type="dateTime">2026-08-26T21:06:23Z</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>CNCNCN1C=NC2=CC=CC=C2C1=O</moldb-smiles> <moldb-formula>C11H14N4O</moldb-formula> <moldb-inchi>InChI=1S/C11H14N4O/c1-12-6-13-7-15-8-14-10-5-3-2-4-9(10)11(15)16/h2-5,8,12-13H,6-7H2,1H3</moldb-inchi> <moldb-inchikey>BOXVWSKHFHPGDZ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">218.1167611</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>0.6</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>CHEM277046</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>3-[(methylaminomethylamino)methyl]quinazolin-4-one</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>Diazanaphthalenes</klass> <subklass>Benzodiazines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0233146</sync-id> <structure-inchikey>BOXVWSKHFHPGDZ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>8000001000000000000000000000000000004000000000000000c08000200000200000000020000000000000000000000000000000800000000000000000000000000000040000200000000000000000008000000000000000000000000000000000000000000000000009000000000000000088000000000000c0000000804000000000000080000000000100000000000000000000000000000000000000040001080000000000020000090000000000000000000000000000040000000020000000000000000000000000000000000200000000000000000000000000000040000000000000000000000000000010000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAQAAAAEQAAAIABBgBgAAAAAQMHAGAAAAAC AQYAYAAAAAICBwBgAAAAAgEGAGAAAAACAgdAKAAAAAMDBkBoAAAAAwMBB0Ao AAAAAwMGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZAaAAA AAMDAQZAKAAAAAMEBkAoAAAAAwQIACgAAAADAgsAAQABAgACAwADBAAEBQAF BmgMBgdoDAcIaAwICWgMCQpoDAoLaAwLDGgMDA1oDA0OaAwODygCDgVoDA0I aAxCAgAAAAYFDg0IBwYGCQoLDA0IFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:56:16Z</structure-indexed-at> </compound>