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<compound>
  <id type="integer">316461</id>
  <title nil="true"/>
  <common-name>2-[4-[(6,7-dichloro-1,3-benzothiazol-2-yl)diazenyl]-n,3-dimethylanilino]ethyl acetate</common-name>
  <description>2-[4-[(6,7-dichloro-1,3-benzothiazol-2-yl)diazenyl]-n,3-dimethylanilino]ethyl acetate is a chemical compound with the formula C19H18Cl2N4O2S. It has an average molecular weight of 437.30 g/mol.</description>
  <cas>124621-01-8</cas>
  <pubchem-id>14512535</pubchem-id>
  <chemical-formula>C19H18Cl2N4O2S</chemical-formula>
  <weight>437.3</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">2026-08-29T14:15:07Z</created-at>
  <updated-at type="dateTime">2026-08-29T14:15:07Z</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>CC1=C(C=CC(=C1)N(C)CCOC(=O)C)N=NC2=NC3=C(S2)C(=C(C=C3)Cl)Cl</moldb-smiles>
  <moldb-formula>C19H18Cl2N4O2S</moldb-formula>
  <moldb-inchi>InChI=1S/C19H18Cl2N4O2S/c1-11-10-13(25(3)8-9-27-12(2)26)4-6-15(11)23-24-19-22-16-7-5-14(20)17(21)18(16)28-19/h4-7,10H,8-9H2,1-3H3</moldb-inchi>
  <moldb-inchikey>XTWINZWVHARWNM-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">436.0527524</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>6.1</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
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  <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>CHEM312354</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-[(6,7-dichloro-1,3-benzothiazol-2-yl)diazenyl]-n,3-dimethylanilino]ethyl acetate</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>Benzothiazoles</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0267296</sync-id>
  <structure-inchikey>XTWINZWVHARWNM-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>420000000800000008000000000021000110020000000000000000000000000000000000000801000100000020020000000000000400000000000000000000000000000004000000000000200000000200020100801000000040000000000000000000100000000020000001040000000000010000000c010000000001040001000004000000000d400000000000000100000000000000000000000000400000000000000000001000008080900000000000000000000000001000000000000000000000000000000000000000000080010000000002000000200000000000000000000000001000048000000000400000801000000000000000000000000</structure-fingerprint>
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  <structure-indexed-at type="dateTime">2026-09-19T05:22:32Z</structure-indexed-at>
</compound>
