334777 <common-name>2-[[4-(4-bromophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-n-(3,5-dimethoxyphenyl)acetamide</common-name> <description>2-[[4-(4-bromophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-n-(3,5-dimethoxyphenyl)acetamide is a chemical compound with the formula C23H20BrN5O3S. With an average molecular weight of 526.40 g/mol, 2-[[4-(4-bromophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-n-(3,5-dimethoxyphenyl)acetamide is a heavy molecule.</description> <cas>477330-88-4</cas> <pubchem-id>1420565</pubchem-id> <chemical-formula>C23H20BrN5O3S</chemical-formula> <weight>526.4</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">2026-08-30T16:37:14Z</created-at> <updated-at type="dateTime">2026-08-30T16:37:14Z</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>COC1=CC(=CC(=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Br)C4=CN=CC=C4)OC</moldb-smiles> <moldb-formula>C23H20BrN5O3S</moldb-formula> <moldb-inchi>InChI=1S/C23H20BrN5O3S/c1-31-19-10-17(11-20(12-19)32-2)26-21(30)14-33-23-28-27-22(15-4-3-9-25-13-15)29(23)18-7-5-16(24)6-8-18/h3-13H,14H2,1-2H3,(H,26,30)</moldb-inchi> <moldb-inchikey>RMWLDQHACTWCLN-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">525.04702</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.1</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>CHEM330670</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>2-[[4-(4-bromophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-n-(3,5-dimethoxyphenyl)acetamide</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>Pyridines and derivatives</klass> <subklass>Pyridyltriazoles</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0285254</sync-id> <structure-inchikey>RMWLDQHACTWCLN-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>4000200000880000000800000000000000000100000000004000004000000000000000200004008000002080000000000004000000000000000000000000000000000000000000000000000020000000000100000000808010000000040000010000000040000000100000040400000100000000000000000000000100100040000000800000000000000084880000010000002000000000000000000000000000000000000000080000002000000000410000000000002c00000180000000000020001000000100004000100000000000002000000200000000000000008040000000002040000000000400000000010000000040000000000000</structure-fingerprint> 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