321606 <common-name>N-[2-(fluoromethyl)-3-(2-methylphenyl)-4-oxoquinazolin-6-yl]butanamide</common-name> <description>N-[2-(fluoromethyl)-3-(2-methylphenyl)-4-oxoquinazolin-6-yl]butanamide is a compound with the formula C20H20FN3O2. It has an average molecular weight of 353.40 g/mol.</description> <cas nil="true"/> <pubchem-id>63487</pubchem-id> <chemical-formula>C20H20FN3O2</chemical-formula> <weight>353.4</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">2026-08-29T21:11:00Z</created-at> <updated-at type="dateTime">2026-08-29T21:11:00Z</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>CCCC(=O)NC1=CC2=C(C=C1)N=C(N(C2=O)C3=CC=CC=C3C)CF</moldb-smiles> <moldb-formula>C20H20FN3O2</moldb-formula> <moldb-inchi>InChI=1S/C20H20FN3O2/c1-3-6-19(25)22-14-9-10-16-15(11-14)20(26)24(18(12-21)23-16)17-8-5-4-7-13(17)2/h4-5,7-11H,3,6,12H2,1-2H3,(H,22,25)</moldb-inchi> <moldb-inchikey>DBIBUWKNNLBCMR-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">353.1539551</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.9</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>CHEM317499</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>N-[2-(fluoromethyl)-3-(2-methylphenyl)-4-oxoquinazolin-6-yl]butanamide</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>CED0272324</sync-id> <structure-inchikey>DBIBUWKNNLBCMR-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000008100000000100000000000000081000000000000000000000000020000220000000000000020040000000000000000000100000000801000000000400000000001000000000000200000000000040000000000000000000000200100000000100000001000001400002001000000400000000000010000000000400000008040000000000000800000000001000000000100000000000001000000000000000400000a0100000000000000000000000000000000000000000008000000002000000000010000000000000000002000000200000000000000008000000001000040000000000400800000000000000041000000000000</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�B������� ���� ��� �����������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:26:23Z</structure-indexed-at> </compound>