1-[2-(Aminosulfonyl)-6-benzothiazolyl] 2-ethyl ethanedioate

Base Information

• Chemical Name: 1-[2-(Aminosulfonyl)-6-benzothiazolyl] 2-ethyl ethanedioate
• CAS No.: 137836-89-6
• Molecular Formula: C11H10N2O6S2
• DSSTox Substance ID: DTXSID601189847

Synonyms:DTXSID601189847;137836-89-6;1-[2-(Aminosulfonyl)-6-benzothiazolyl] 2-ethyl ethanedioate

Chemical Property of 1-[2-(Aminosulfonyl)-6-benzothiazolyl] 2-ethyl ethanedioate

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 6
• Exact Mass: 329.99802839
• Heavy Atom Count: 21
• Complexity: 517

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MSDS Files:

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• Canonical SMILES: CCOC(=O)C(=O)OC1=CC2=C(C=C1)N=C(S2)S(=O)(=O)N

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