2,3,4,5-Tetrahydro-7,8-dimethoxy-3-(methylsulfonyl)-1H-3-benzazepin-1-one

Base Information

• Chemical Name: 2,3,4,5-Tetrahydro-7,8-dimethoxy-3-(methylsulfonyl)-1H-3-benzazepin-1-one
• CAS No.: 14256-81-6
• Molecular Formula: C₁₃H₁₇NO₅S
• Molecular Weight: 299.348
• DSSTox Substance ID: DTXSID501148173

Synonyms:DTXSID501148173;2,3,4,5-Tetrahydro-7,8-dimethoxy-3-(methylsulfonyl)-1H-3-benzazepin-1-one;14256-81-6

Chemical Property of 2,3,4,5-Tetrahydro-7,8-dimethoxy-3-(methylsulfonyl)-1H-3-benzazepin-1-one

Chemical Property:

• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 299.08274382
• Heavy Atom Count: 20
• Complexity: 458

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MSDS Files:

Useful:

• Canonical SMILES: COC1=C(C=C2C(=C1)CCN(CC2=O)S(=O)(=O)C)OC

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