4-(Isopropylamino)-2-(methylthio)pyrimidine-5-carboxylic Acid

Base Information

• Chemical Name: 4-(Isopropylamino)-2-(methylthio)pyrimidine-5-carboxylic Acid
• CAS No.: 76360-88-8
• Molecular Formula: C₉H₁₃N₃O₂S
• Molecular Weight: 227.287
• DSSTox Substance ID: DTXSID101161260

Synonyms:4-(Isopropylamino)-2-(methylthio)pyrimidine-5-carboxylic Acid;76360-88-8;SCHEMBL3971245;IPIYOTSHMSSGLY-UHFFFAOYSA-N;DTXSID101161260;AKOS015938524;FT-0759550;4-[(1-Methylethyl)amino]-2-(methylthio)-5-pyrimidinecarboxylic acid

Chemical Property of 4-(Isopropylamino)-2-(methylthio)pyrimidine-5-carboxylic Acid

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 227.07284784
• Heavy Atom Count: 15
• Complexity: 225

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MSDS Files:

Useful:

• Canonical SMILES: CC(C)NC1=NC(=NC=C1C(=O)O)SC

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