2-[(6-Chloropyridin-3-yl)methylsulfanyl]-1,3-benzothiazole

Base Information

• Chemical Name: 2-[(6-Chloropyridin-3-yl)methylsulfanyl]-1,3-benzothiazole
• CAS No.: 821782-43-8
• Molecular Formula: C13H9ClN2S2
• DSSTox Substance ID: DTXSID60363022
• Wikidata: Q82146566

Synonyms:821782-43-8;2-[(6-chloropyridin-3-yl)methylsulfanyl]-1,3-benzothiazole;2-{[(6-chloro-3-pyridinyl)methyl]sulfanyl}-1,3-benzothiazole;2X-0847;2-{[(6-chloropyridin-3-yl)methyl]sulfanyl}-1,3-benzothiazole;Bionet2_001528;DTXSID60363022;HMS1368G09;AKOS000215026

Chemical Property of 2-[(6-Chloropyridin-3-yl)methylsulfanyl]-1,3-benzothiazole

Chemical Property:

• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 291.9895683
• Heavy Atom Count: 18
• Complexity: 280

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N=C(S2)SCC3=CN=C(C=C3)Cl

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