346734 <common-name>N-[4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-2h-1,4-benzoxazin-3-amine</common-name> <description>N-[4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-2h-1,4-benzoxazin-3-amine is a chemical compound with the formula C27H30N4O2. It has an average molecular weight of 442.60 g/mol.</description> <cas>85868-67-3</cas> <pubchem-id>55426</pubchem-id> <chemical-formula>C27H30N4O2</chemical-formula> <weight>442.6</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">2026-08-31T10:15:32Z</created-at> <updated-at type="dateTime">2026-08-31T10:15:32Z</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>C1CN(CCN1CCCOC2=CC=C(C=C2)NC3=NC4=CC=CC=C4OC3)C5=CC=CC=C5</moldb-smiles> <moldb-formula>C27H30N4O2</moldb-formula> <moldb-inchi>InChI=1S/C27H30N4O2/c1-2-7-23(8-3-1)31-18-16-30(17-19-31)15-6-20-32-24-13-11-22(12-14-24)28-27-21-33-26-10-5-4-9-25(26)29-27/h1-5,7-14H,6,15-21H2,(H,28,29)</moldb-inchi> <moldb-inchikey>UWNUSBNMLHSCEI-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">442.2368762</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.5</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>CHEM342627</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-[4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-2h-1,4-benzoxazin-3-amine</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>Diazinanes</klass> <subklass>Piperazines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0297085</sync-id> <structure-inchikey>UWNUSBNMLHSCEI-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>44000000000000020a00002000000000000000000000100000000000000000000000000000000200000000000002004000100000000c0000000000010000000000000000000000000000040000000000480000001010000020000000000000100000000000000001000000000000400000003010080000000000000000000002000400000000080000000000000408000100000010000000000000000000000000000000000000000000008000004000000000008002000e000000800080000000000000000001000000000000000000000000008800000000200000000010000000040000000000040000000410000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAhAAAAJQAAAIABBgBgAAAAAgIGAGAAAAAC AgcAKAAAAAMDBgBgAAAAAgIGAGAAAAACAgcAIAAAAAMGAGAAAAACAgYAYAAA AAICBgBgAAAAAgIIACgAAAADAgZAKAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMB BkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEHAGgAAAADAgEGACgAAAADBAcA KAAAAAMDBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQGgAAAADAwEGQGgA AAADAwEGQCgAAAADBAgAKAAAAAMCBgBgAAAAAgIGQCgAAAADBAZAaAAAAAMD AQZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQsAAQABAgAC AwADBAAEBQAFBgAGBwAHCAAICQAJCiAKC2gMCwxoDAwNaAwNDmgMDg9oDA0Q IBARIBESKAISEyATFGgMFBVoDBUWaAwWF2gMFxhoDBgZIBkaAAIbIBscaAwc HWgMHR5oDB4faAwfIGgMBQAADwpoDBoRABgTaAwgG2gMQgUAAAAGAAUEAwIB BgsMDQ4PCgYSExgZGhEGFBUWFxgTBhwdHh8gGxcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:45:23Z</structure-indexed-at> </compound>