3-[2-(Azepan-1-YL)ethyl]-6-propyl-1,3-benzothiazol-2-one

Base Information

• Chemical Name: 3-[2-(Azepan-1-YL)ethyl]-6-propyl-1,3-benzothiazol-2-one
• CAS No.: 876953-20-7
• Molecular Formula: C18H26N2OS
• DSSTox Substance ID: DTXSID50429545
• Wikidata: Q82242551
• ChEMBL ID: CHEMBL272899

Synonyms:3-(2-(azepan-1-yl)ethyl)-6-propylbenzo(d)thiazol-2(3H)-one;SN56 compound

Chemical Property of 3-[2-(Azepan-1-YL)ethyl]-6-propyl-1,3-benzothiazol-2-one

Chemical Property:

• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 318.17658463
• Heavy Atom Count: 22
• Complexity: 368

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC1=CC2=C(C=C1)N(C(=O)S2)CCN3CCCCCC3

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