<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">315992</id>
  <title nil="true"/>
  <common-name>[4-(4-chlorophenyl)-5-(2-methoxy-2-oxoethyl)-1,3-thiazol-2-yl]-[(2-chlorophenyl)methyl]sulfamic acid</common-name>
  <description>[4-(4-chlorophenyl)-5-(2-methoxy-2-oxoethyl)-1,3-thiazol-2-yl]-[(2-chlorophenyl)methyl]sulfamic acid is a chemical compound with the formula C19H16Cl2N2O5S2. It has an average molecular weight of 487.40 g/mol.</description>
  <cas>102367-77-1</cas>
  <pubchem-id>24846663</pubchem-id>
  <chemical-formula>C19H16Cl2N2O5S2</chemical-formula>
  <weight>487.4</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">2026-08-29T13:34:11Z</created-at>
  <updated-at type="dateTime">2026-08-29T13:34:11Z</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>COC(=O)CC1=C(N=C(S1)N(CC2=CC=CC=C2Cl)S(=O)(=O)O)C3=CC=C(C=C3)Cl</moldb-smiles>
  <moldb-formula>C19H16Cl2N2O5S2</moldb-formula>
  <moldb-inchi>InChI=1S/C19H16Cl2N2O5S2/c1-28-17(24)10-16-18(12-6-8-14(20)9-7-12)22-19(29-16)23(30(25,26)27)11-13-4-2-3-5-15(13)21/h2-9H,10-11H2,1H3,(H,25,26,27)</moldb-inchi>
  <moldb-inchikey>XIVJKQVMLPWWMU-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">485.9877694</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.2</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>CHEM311885</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>[4-(4-chlorophenyl)-5-(2-methoxy-2-oxoethyl)-1,3-thiazol-2-yl]-[(2-chlorophenyl)methyl]sulfamic acid</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>Thiazoles</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0266835</sync-id>
  <structure-inchikey>XIVJKQVMLPWWMU-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000000000000000002000000010000080000000000000000001000000140000020002002000000000000200000000010000000010000000001000400000008000000000000020000010000100000000000004000000000000010080000040000000004000800000000000000008020000000000000000000040020000800000000000000080804000004100000000000000002000000000000000000004000200082000000000000000000000080000000000040000000000000000060000000100000000000018000000000100000200000000000000000000000001000040000000000400000000000040000000400000000000</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��
 
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��������������� ��h���h���h���h���h����	�h���h���h�B���������	�����������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:22:09Z</structure-indexed-at>
</compound>
