2-[(4-Methylpiperazin-1-yl)disulfanyl]-1,3-benzothiazole

Base Information

• Chemical Name: 2-[(4-Methylpiperazin-1-yl)disulfanyl]-1,3-benzothiazole
• CAS No.: 52663-52-2
• Molecular Formula: C12H15N3S3
• Molecular Weight: 297.46300
• DSSTox Substance ID: DTXSID60566657
• Wikidata: Q82452374
• Mol file: 52663-52-2.mol

Synonyms:2-[(4-Methylpiperazin-1-yl)disulfanyl]-1,3-benzothiazole;52663-52-2;SCHEMBL9687398;DTXSID60566657

Chemical Property of 2-[(4-Methylpiperazin-1-yl)disulfanyl]-1,3-benzothiazole

Chemical Property:

• PSA: 98.21000
• LogP: 3.07480
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 297.04281101
• Heavy Atom Count: 18
• Complexity: 271

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCN(CC1)SSC2=NC3=CC=CC=C3S2

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