<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-03-31 20:49:53 UTC</creation_date>
  <update_date>2026-08-19 16:46:19 UTC</update_date>
  <accession/>
  <common_name>N-(6-Aminohexyl)-5-chlor-1-naphthalensulfonamid</common_name>
  <class>SmallMolecule</class>
  <description>N-(6-Aminohexyl)-5-chlor-1-naphthalensulfonamid is an organic compound with the formula C16H21Cl1N2O2S1 and an average molecular weight of 340.90 g/mol. N-(6-Aminohexyl)-5-chlor-1-naphthalensulfonamid belongs to the naphthalene sulfonic acids and derivatives, a subclass of naphthalenes within the organic compounds.

This compound is associated with one recorded source: healthcare, pharmaceuticals &amp; veterinary products, specifically antibiotics. Exposure to this substance may occur through oral or inhalation routes. In terms of biological activity, it interacts with five recorded protein targets. These include calmodulin-1 (CALM1), calmodulin-2 (CALM2), troponin I of the cardiac muscle (TNNI3), and troponin C of slow skeletal and cardiac muscles (TNNC1), as well as one other protein.</description>
  <categories/>
  <types/>
  <synonyms>
    <synonym>1-naphthalenesulfonamide, n-(6-aminohexyl)-5- chloro-</synonym>
    <synonym>1-Naphthalenesulfonamide, N-(6-aminohexyl)-5-chloro-</synonym>
    <synonym>6-[(5-chloro-1-naphthalenyl)sulfonylamino]hexylammonium</synonym>
    <synonym>C017967</synonym>
    <synonym>C16H21ClN2O2S</synonym>
    <synonym>CHEMBL41631</synonym>
    <synonym>N-(6-aminohexyl)-1-chloro-naphthalene-5-sulfonamide</synonym>
    <synonym>N-(6-Aminohexyl)-5-chlor-1-naphthalensulfonamid</synonym>
    <synonym>N-(6-Aminohexyl)-5-chloro-1-naphtalÃƒÆ’Ã‚Â¨nesulfonamide</synonym>
    <synonym>N-(6-Aminohexyl)-5-chloro-1-naphthalenesulfonamide</synonym>
    <synonym>N-(6-Aminohexyl)-5-chloro-1-naphthalenesulphonamide</synonym>
    <synonym>N-(6-aminohexyl)-5-chloronaphthalene-1-sulfonamide</synonym>
    <synonym>W 7</synonym>
    <synonym>W 7, monohydrochloride</synonym>
    <synonym>W-7</synonym>
    <synonym>W7</synonym>
    <synonym>WW7</synonym>
  </synonyms>
  <chemical_formula>C16H21Cl1N2O2S1</chemical_formula>
  <average_molecular_weight>340.9</average_molecular_weight>
  <monisotopic_moleculate_weight>340.101226</monisotopic_moleculate_weight>
  <iupac_name>N-(6-aminohexyl)-5-chloronaphthalene-1-sulfonamide</iupac_name>
  <traditional_iupac>C16H21clN2O2S</traditional_iupac>
  <cas_registry_number>65595-90-6</cas_registry_number>
  <smiles/>
  <inchi>InChI=1S/C16H21ClN2O2S/c17-15-9-5-8-14-13(15)7-6-10-16(14)22(20,21)19-12-4-2-1-3-11-18/h5-10,19H,1-4,11-12,18H2</inchi>
  <inchikey>IDEHCMNLNCJQST-UHFFFAOYSA-N</inchikey>
  <taxonomy>
    <kingdom>Organic compounds</kingdom>
    <super_class>Benzenoids</super_class>
    <class>Naphthalenes</class>
    <sub_class>Naphthalene sulfonic acids and derivatives</sub_class>
    <direct_parent>1-naphthalene sulfonic acids and derivatives</direct_parent>
    <alternate_parents>
      <alternative_parent>1-naphthalene sulfonamides</alternative_parent>
      <alternative_parent>Aminosulfonyl compounds</alternative_parent>
      <alternative_parent>Aryl chlorides</alternative_parent>
      <alternative_parent>Chloronaphthalenes</alternative_parent>
      <alternative_parent>Hydrocarbon derivatives</alternative_parent>
      <alternative_parent>Monoalkylamines</alternative_parent>
      <alternative_parent>Organic oxides</alternative_parent>
      <alternative_parent>Organochlorides</alternative_parent>
      <alternative_parent>Organopnictogen compounds</alternative_parent>
      <alternative_parent>Organosulfonamides</alternative_parent>
    </alternate_parents>
    <substituents>
      <substituent>1-naphthalene sulfonamide</substituent>
      <substituent>1-naphthalene sulfonic acid or derivatives</substituent>
      <substituent>Amine</substituent>
      <substituent>Aminosulfonyl compound</substituent>
      <substituent>Aromatic homopolycyclic compound</substituent>
      <substituent>Aryl chloride</substituent>
      <substituent>Aryl halide</substituent>
      <substituent>Chloronaphthalene</substituent>
      <substituent>Hydrocarbon derivative</substituent>
      <substituent>Naphthalene sulfonamide</substituent>
      <substituent>Organic nitrogen compound</substituent>
      <substituent>Organic oxide</substituent>
      <substituent>Organic oxygen compound</substituent>
      <substituent>Organic sulfonic acid or derivatives</substituent>
      <substituent>Organochloride</substituent>
      <substituent>Organohalogen compound</substituent>
      <substituent>Organonitrogen compound</substituent>
      <substituent>Organopnictogen compound</substituent>
      <substituent>Organosulfonic acid amide</substituent>
      <substituent>Organosulfonic acid or derivatives</substituent>
      <substituent>Organosulfur compound</substituent>
      <substituent>Primary aliphatic amine</substituent>
      <substituent>Primary amine</substituent>
      <substituent>Sulfonyl</substituent>
    </substituents>
    <molecular_framework>Aromatic homopolycyclic compounds</molecular_framework>
    <descriptors/>
  </taxonomy>
  <status>Detected and Not Quantified</status>
  <origin/>
  <cellular_locations/>
  <biofluid_locations/>
  <tissue_locations/>
  <pathways/>
  <state/>
  <appearance/>
  <experimental_properties>
    <property>
      <kind>logp</kind>
      <value>3.3</value>
    </property>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>logp</kind>
      <value>2.49</value>
      <source>ALOGPS</source>
    </property>
    <property>
      <kind>logs</kind>
      <value>-5.30</value>
      <source>ALOGPS</source>
    </property>
    <property>
      <kind>solubility</kind>
      <value>1.72e-03 g/l</value>
      <source>ALOGPS</source>
    </property>
    <property>
      <kind>logp</kind>
      <value>2.45</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>pka_strongest_acidic</kind>
      <value>9.72</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>pka_strongest_basic</kind>
      <value>10.38</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>iupac</kind>
      <value>N-(6-aminohexyl)-5-chloronaphthalene-1-sulfonamide</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>average_mass</kind>
      <value>340.9</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>340.101226</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C16H21Cl1N2O2S1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C16H21ClN2O2S/c17-15-9-5-8-14-13(15)7-6-10-16(14)22(20,21)19-12-4-2-1-3-11-18/h5-10,19H,1-4,11-12,18H2</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>IDEHCMNLNCJQST-UHFFFAOYSA-N</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>polar_surface_area</kind>
      <value>72.19</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>refractivity</kind>
      <value>91.03</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>polarizability</kind>
      <value>36.12</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>rotatable_bond_count</kind>
      <value>7</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>acceptor_count</kind>
      <value>3</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>donor_count</kind>
      <value>2</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>physiological_charge</kind>
      <value>1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formal_charge</kind>
      <value>0</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
  <route_of_exposure/>
  <mechanism_of_toxicity/>
  <metabolism/>
  <toxicity/>
  <lethaldose/>
  <carcinogenicity/>
  <use_source/>
  <min_risk_level/>
  <health_effects>#&lt;HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7225e1d720&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id>DB04513</drugbank_id>
  <hmdb_id/>
  <pubchem_compound_id>5681</pubchem_compound_id>
  <chembl_id/>
  <chemspider_id>5479</chemspider_id>
  <kegg_id/>
  <uniprot_id/>
  <omim_id/>
  <chebi_id/>
  <biocyc_id/>
  <ctd_id/>
  <stitch_id/>
  <actor_id/>
  <pdb_id/>
  <wikipidia/>
  <general_references/>
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</compound>
