279789 <common-name>7-phenyl-2h-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-one</common-name> <description>7-phenyl-2h-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-one belongs to the 1,2,4-triazines, a subclass of triazines within the organic compounds. This organoheterocyclic compound has the chemical formula C10H7N5O and an average molecular weight of 213.20 g/mol.</description> <cas>86869-93-4</cas> <pubchem-id>6410671</pubchem-id> <chemical-formula>C10H7N5O</chemical-formula> <weight>213.2</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">2026-08-26T19:43:24Z</created-at> <updated-at type="dateTime">2026-08-26T19:43:24Z</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>C1=CC=C(C=C1)C2=NC3=NNC(=O)N3N=C2</moldb-smiles> <moldb-formula>C10H7N5O</moldb-formula> <moldb-inchi>InChI=1S/C10H7N5O/c16-10-14-13-9-12-8(6-11-15(9)10)7-4-2-1-3-5-7/h1-6H,(H,14,16)</moldb-inchi> <moldb-inchikey>SDDMAWPFOSFTTC-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">213.0650599</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>0.8</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>CHEM275682</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>7-phenyl-2h-[1,2,4]triazolo[4,3-b][1,2,4]triazin-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>Triazines</klass> <subklass>1,2,4-triazines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0231839</sync-id> <structure-inchikey>SDDMAWPFOSFTTC-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>1000000020000000000000000000000000000000000000000000000000000000000022000000000000002004000008000000000800000000000000000000000000000000000000000000008020000000000000000000008000020000000000000000000000000000000000000000000100000000000800080000000000000000000000800000201000000000800000000100400000000000000000001000000000000000000000080000000000000000000000000000000000000100000000100004000000000020000000000000000000000000000200000000000000000000000001000040000000000000000000000010000000080000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAQAAAAEgAAAIABBkBoAAAAAwMBBkBoAAAA AwMBBkBoAAAAAwMBBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQCgAAAAD BAdAKAAAAAMDBkAoAAAAAwQHQCgAAAADAwdAOAAAAAMBAwZAKAAAAAMECAAo AAAAAwIHQCgAAAADAwdAKAAAAAMDBkBoAAAAAwMBCwABaAwBAmgMAgNoDAME aAwEBWgMAwYgBgdoDAcIaAwICWgMCQpoDAoLaAwLDCgCCw1oDA0OaAwOD2gM BQBoDA8GaAwNCGgMQgMAAAAGAAUEAwIBBgcIDQ4PBgUJCA0LChcEAAAAAAAA ABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:55:01Z</structure-indexed-at> </compound>