5-[(4-hydroxy-3,5-dimethoxyphenyl)methylene]-4-oxo-2-thioxo-3-Thiazolidineacetic acid

Base Information

• Chemical Name: 5-[(4-hydroxy-3,5-dimethoxyphenyl)methylene]-4-oxo-2-thioxo-3-Thiazolidineacetic acid
• CAS No.: 120841-38-5
• Molecular Formula: C14H13NO6S2
• DSSTox Substance ID: DTXSID101127907

Synonyms:DTXSID101127907;5-[(4-hydroxy-3,5-dimethoxyphenyl)methylene]-4-oxo-2-thioxo-3-Thiazolidineacetic acid;120841-38-5

Chemical Property of 5-[(4-hydroxy-3,5-dimethoxyphenyl)methylene]-4-oxo-2-thioxo-3-Thiazolidineacetic acid

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 355.01842948
• Heavy Atom Count: 23
• Complexity: 523

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MSDS Files:

Useful:

• Canonical SMILES: COC1=CC(=CC(=C1O)OC)C=C2C(=O)N(C(=S)S2)CC(=O)O

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