292349 <common-name>8-chloro-4-[2-(dimethylamino)propyl]-2-methyl-6-nitro-1,4-benzoxazin-3-one</common-name> <description>8-chloro-4-[2-(dimethylamino)propyl]-2-methyl-6-nitro-1,4-benzoxazin-3-one belongs to the benzoxazinones, a subclass of benzoxazines within the organic compounds. It is an organoheterocyclic compound with the formula C14H18ClN3O4 and an average molecular weight of 327.76 g/mol.</description> <cas nil="true"/> <pubchem-id>42343</pubchem-id> <chemical-formula>C14H18ClN3O4</chemical-formula> <weight>327.76</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">2026-08-28T07:38:34Z</created-at> <updated-at type="dateTime">2026-08-28T07:38:34Z</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>CC1C(=O)N(C2=C(O1)C(=CC(=C2)[N+](=O)[O-])Cl)CC(C)N(C)C</moldb-smiles> <moldb-formula>C14H18ClN3O4</moldb-formula> <moldb-inchi>InChI=1S/C14H18ClN3O4/c1-8(16(3)4)7-17-12-6-10(18(20)21)5-11(15)13(12)22-9(2)14(17)19/h5-6,8-9H,7H2,1-4H3</moldb-inchi> <moldb-inchikey>XIPWGRHHRBSABJ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">327.0985838</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.4</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>CHEM288242</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>8-chloro-4-[2-(dimethylamino)propyl]-2-methyl-6-nitro-1,4-benzoxazin-3-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>Benzoxazines</klass> <subklass>Benzoxazinones</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0243912</sync-id> <structure-inchikey>XIPWGRHHRBSABJ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>44000000000000000000c00000000000000008000000000000000000000000000000001000000020000000000002000000000000000000000000000000000000000000000000400040080000200000000028800000000000001000000002400000000000000000000200000000104000000000000100000000100000000000100000000040000000000000002040000000100000001000000000000000000060000300040200020000000000080800000000000000000000000000000014000000000000000000000000000000000800000010000000000000000000000000000000400000000000000040000000000020000000001000800000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������(�������(�������(������@(������@(�������(������@(������@h�������@(������@h������� *��������(������ *���ÿ���� ������`�������`�������`������� ������`�������`��������������(��� �� ��h��� ��h�� h� h� �h� � � (��� ��������������������������h�B������������� �������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:04:32Z</structure-indexed-at> </compound>