2-(2-mercapto-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)-N-(4-nitrophenyl)acetamide

Base Information

• Chemical Name: 2-(2-mercapto-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)-N-(4-nitrophenyl)acetamide
• CAS No.: 1142200-43-8
• Molecular Formula: C11H9N3O4S2
• Molecular Weight: 311.3
• DSSTox Substance ID: DTXSID801193272
• Mol file: 1142200-43-8.mol

Synonyms:2-(2-mercapto-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)-N-(4-nitrophenyl)acetamide;1142200-43-8;5-Thiazolidineacetamide, N-(4-nitrophenyl)-4-oxo-2-thioxo-;N-(4-nitrophenyl)-2-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yl)acetamide;DTXSID801193272;STK505270;AKOS005214349;N-(4-nitrophenyl)-2-(4-oxo-2-sulfanyl-4,5-dihydro-1,3-thiazol-5-yl)acetamide

Chemical Property of 2-(2-mercapto-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)-N-(4-nitrophenyl)acetamide

Chemical Property:

• PKA: 4.70±0.50(Predicted)
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 311.00344812
• Heavy Atom Count: 20
• Complexity: 443

Purity/Quality:

98%min ^*data from raw suppliers

2-(2-Mercapto-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)-N-(4-nitrophenyl)acetamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1NC(=O)CC2C(=O)NC(=S)S2)[N+](=O)[O-]