321415 <common-name>Ethyl 2-(3-oxo-5,6-diphenyl-1,2,4-triazin-2-yl)propanoate</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>3065749</pubchem-id> <chemical-formula>C20H19N3O3</chemical-formula> <weight>349.4</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">2026-08-29T20:52:49Z</created-at> <updated-at type="dateTime">2026-08-29T20:52:49Z</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>CCOC(=O)C(C)N1C(=O)N=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3</moldb-smiles> <moldb-formula>C20H19N3O3</moldb-formula> <moldb-inchi>InChI=1S/C20H19N3O3/c1-3-26-19(24)14(2)23-20(25)21-17(15-10-6-4-7-11-15)18(22-23)16-12-8-5-9-13-16/h4-14H,3H2,1-2H3</moldb-inchi> <moldb-inchikey>RCFDLAFUVHNUIO-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">349.1426415</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.5</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>CHEM317308</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>Ethyl 2-(3-oxo-5,6-diphenyl-1,2,4-triazin-2-yl)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>Organic acids and derivatives</superklass> <klass>Carboxylic acids and derivatives</klass> <subklass>Amino acids, peptides, and analogues</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0272136</sync-id> <structure-inchikey>RCFDLAFUVHNUIO-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000800000000000000010000000000000000000000000000000001002000020100000000000002004000000000000000000010000000000000000000000000000000000000000080020000000000100080000008000000000000000010000000000000000000000000000000100000000002000000000000000000040001000800000000000000002800000000100000802020001000000000000000000000000000000080000000000000000000000000000000000000000000000000000000000000000000000000000000000002000000204000000000000002000000001000040010000000400000000080400000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������(�������(�������(�������`�������`������@(������@(�������(������@(������@(������@(������@(������@(������@h�������@h�������@h�������@h�������@h�������@(������@h�������@h�������@h�������@h�������@h��������������� ��(������������h�� (�� h� �h���h�� h��� ��h���h���h���h���h��� ��h���h���h���h���h� �h���h���h�B������ �� �������������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:26:15Z</structure-indexed-at> </compound>