299432 <common-name>3-(2-fluorophenyl)-4-[(e)-(2-hydroxy-3,5-diiodophenyl)methylideneamino]-1h-1,2,4-triazole-5-thione</common-name> <description>3-(2-fluorophenyl)-4-[(e)-(2-hydroxy-3,5-diiodophenyl)methylideneamino]-1h-1,2,4-triazole-5-thione belongs to the triazoles, a subclass of azoles within the organic compounds. It is classified as an organoheterocyclic compound with the formula C15H9FI2N4OS. With an average molecular weight of 566.10 g/mol, 3-(2-fluorophenyl)-4-[(e)-(2-hydroxy-3,5-diiodophenyl)methylideneamino]-1h-1,2,4-triazole-5-thione is a heavy molecule.</description> <cas>579444-12-5</cas> <pubchem-id>135613196</pubchem-id> <chemical-formula>C15H9FI2N4OS</chemical-formula> <weight>566.1</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">2026-08-28T15:59:15Z</created-at> <updated-at type="dateTime">2026-08-28T15:59:15Z</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=NNC(=S)N2N=CC3=C(C(=CC(=C3)I)I)O)F</moldb-smiles> <moldb-formula>C15H9FI2N4OS</moldb-formula> <moldb-inchi>InChI=1S/C15H9FI2N4OS/c16-11-4-2-1-3-10(11)14-20-21-15(24)22(14)19-7-8-5-9(17)6-12(18)13(8)23/h1-7,23H,(H,21,24)/b19-7+</moldb-inchi> <moldb-inchikey>CSSMSPGOBRNBLO-FBCYGCLPSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">565.85706</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.3</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>CHEM295325</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>3-(2-fluorophenyl)-4-[(e)-(2-hydroxy-3,5-diiodophenyl)methylideneamino]-1h-1,2,4-triazole-5-thione</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>Azoles</klass> <subklass>Triazoles</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0250744</sync-id> <structure-inchikey>CSSMSPGOBRNBLO-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>2000804000000000000000800000000020020000000000000000002000000000800020800000200000000000000000100000000000000000000000800000000200000000000010000204000000021000000400000000000000000011000001000000008010000000000000010010004000008000000000008000000000000080000020000000000000000000010000000000000000000000000200000000000040000008000000000000000000000000000000000000000000000000000020202000000000000000000000000004a020000200000000000040000000008000000040000000000000800000000000000000080000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€��@h�������@h�������@h�������@(������@(������@h�������@(������@(������@8�������@(�������(������@(�������(�������h�������@(������@(������@(������@h�������@(������@h������5� ����5� ������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">2026-09-19T05:09:46Z</structure-indexed-at> </compound>