316914 <common-name>Methyl 2-[4-[(2-methyl-6-nitro-2h-1,4-benzoxazin-3-yl)amino]phenyl]propanoate</common-name> <description>Methyl 2-[4-[(2-methyl-6-nitro-2h-1,4-benzoxazin-3-yl)amino]phenyl]propanoate is a chemical compound with the formula C19H19N3O5. It has an average molecular weight of 369.40 g/mol.</description> <cas>109227-00-1</cas> <pubchem-id>3065906</pubchem-id> <chemical-formula>C19H19N3O5</chemical-formula> <weight>369.4</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">2026-08-29T14:47:48Z</created-at> <updated-at type="dateTime">2026-08-29T14:47:48Z</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(=NC2=C(O1)C=CC(=C2)[N+](=O)[O-])NC3=CC=C(C=C3)C(C)C(=O)OC</moldb-smiles> <moldb-formula>C19H19N3O5</moldb-formula> <moldb-inchi>InChI=1S/C19H19N3O5/c1-11(19(23)26-3)13-4-6-14(7-5-13)20-18-12(2)27-17-9-8-15(22(24)25)10-16(17)21-18/h4-12H,1-3H3,(H,20,21)</moldb-inchi> <moldb-inchikey>LVJAGIDKRGIEHV-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">369.1324707</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.1</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>CHEM312807</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>Methyl 2-[4-[(2-methyl-6-nitro-2h-1,4-benzoxazin-3-yl)amino]phenyl]propanoate</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 nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0267745</sync-id> <structure-inchikey>LVJAGIDKRGIEHV-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000042000000000000000000000018000000000104000000000000000000001000040000000000000000002000000000000000800000000000100000008000000000000000000000000000000020800000000100001000000002400000000000011100000250000000100100080000010000000000000000000000100010000040000000000000200000002088001000001000000000000000000020000000040000000000000400080000000000000000000000000010000000080000000000000000000000000000000000000000000000000000000200000000000000420000000004000040000000400400000800001000000000000000000000</structure-fingerprint> 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BAVoDAUGIAUHaAwHCGgMCAloDAkKaAwJCyALDCgCCw0gAg4gDg8gDxBoDBAR aAwREmgMEhNoDBMUaAwSFQAVFgAVFwAXGCgCFxkgGRoABgEACgRoDBQPaAxC AwAAAAYBBgUEAwIGBwgJCgQFBhAREhMUDxcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:22:53Z</structure-indexed-at> </compound>