301754 <common-name>Ethyl 2-[2-(2,4-dichlorophenyl)-2-hydroxy-3-imidazol-1-ylpropyl]sulfanylacetate</common-name> <description>Ethyl 2-[2-(2,4-dichlorophenyl)-2-hydroxy-3-imidazol-1-ylpropyl]sulfanylacetate belongs to the imidazoles, a subclass of azoles within the organic compounds. This organoheterocyclic compound has the chemical formula C16H18Cl2N2O3S and an average molecular weight of 389.30 g/mol.</description> <cas>87049-51-2</cas> <pubchem-id>3070896</pubchem-id> <chemical-formula>C16H18Cl2N2O3S</chemical-formula> <weight>389.3</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">2026-08-28T18:49:10Z</created-at> <updated-at type="dateTime">2026-08-28T18:49:10Z</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)CSCC(CN1C=CN=C1)(C2=C(C=C(C=C2)Cl)Cl)O</moldb-smiles> <moldb-formula>C16H18Cl2N2O3S</moldb-formula> <moldb-inchi>InChI=1S/C16H18Cl2N2O3S/c1-2-23-15(21)8-24-10-16(22,9-20-6-5-19-11-20)13-4-3-12(17)7-14(13)18/h3-7,11,22H,2,8-10H2,1H3</moldb-inchi> <moldb-inchikey>IEFFAEGROMWRIM-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">388.041519</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.8</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>CHEM297647</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-[2-(2,4-dichlorophenyl)-2-hydroxy-3-imidazol-1-ylpropyl]sulfanylacetate</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>Imidazoles</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0252986</sync-id> <structure-inchikey>IEFFAEGROMWRIM-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000002800000010000400000000000080000000000000000002000000000000000002002040008000100000000000000000020000000000000000400000008000000100000020000200000100000000000000000000000000010080004010000000100000000800000900004000000000000000000000000040000000000400000000000000000000080000400000020000000000000000000000000000000004082000000000000000000100000000000000080000000000000000001000000000000200000010008100082000000200000000000000100000000000002040000000080400000000010000000000000000004000</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�B������ � ������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:11:22Z</structure-indexed-at> </compound>