335320 <common-name>[4-[[2-(1,3-benzodioxol-5-yl)-6-methylpyrimidin-4-yl]amino]phenyl]-morpholin-4-ylmethanone</common-name> <description>[4-[[2-(1,3-benzodioxol-5-yl)-6-methylpyrimidin-4-yl]amino]phenyl]-morpholin-4-ylmethanone is a chemical compound with the formula C23H22N4O4. It has an average molecular weight of 418.40 g/mol.</description> <cas>56302-75-1</cas> <pubchem-id>3043889</pubchem-id> <chemical-formula>C23H22N4O4</chemical-formula> <weight>418.4</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">2026-08-30T17:26:47Z</created-at> <updated-at type="dateTime">2026-08-30T17:26:47Z</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>CC1=CC(=NC(=N1)C2=CC3=C(C=C2)OCO3)NC4=CC=C(C=C4)C(=O)N5CCOCC5</moldb-smiles> <moldb-formula>C23H22N4O4</moldb-formula> <moldb-inchi>InChI=1S/C23H22N4O4/c1-15-12-21(26-22(24-15)17-4-7-19-20(13-17)31-14-30-19)25-18-5-2-16(3-6-18)23(28)27-8-10-29-11-9-27/h2-7,12-13H,8-11,14H2,1H3,(H,24,25,26)</moldb-inchi> <moldb-inchikey>DQUDQQLMMCXBPF-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">418.1641052</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3</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>CHEM331213</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>[4-[[2-(1,3-benzodioxol-5-yl)-6-methylpyrimidin-4-yl]amino]phenyl]-morpholin-4-ylmethanone</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>Benzodioxoles</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0285794</sync-id> <structure-inchikey>DQUDQQLMMCXBPF-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>20100000000000000000000000000000000000008000000100001000000000000000000000000000000000000000002000000000000000400000000000104000001000000000000000000000000000000020800000000000000000002000000000000000010000000010000000100000800000020102020000000000000000000010000040000000001000000000000080800000000000000000800400000000000002000000000004000000084000040000000040000000008000008104880000000000000000080000000000010000000000004000002010000200000000000080000000000001010040000000400400000000000000000000004000000000</structure-fingerprint> 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