3-amino-6-methyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one

Base Information

• Chemical Name: 3-amino-6-methyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
• CAS No.: 35523-72-9
• Molecular Formula: C5H7N3OS
• Molecular Weight: 157.19400
• DSSTox Substance ID: DTXSID00355981
• Nikkaji Number: J492.447I
• Wikidata: Q82135089
• Mol file: 35523-72-9.mol

Synonyms:35523-72-9;3-amino-6-methyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one;3-Amino-6-methyl-2-thioxo-2,3-dihyd;3-amino-6-methyl-2-sulfanylidene-1H-pyrimidin-4-one;3-amino-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one;3-amino-6-methyl-2-thio-uracil;DTXSID00355981;3-amino-6-methyl-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone;MFCD00205375;STL440908;AKOS004903203;BP-11784;CS-0451567;7X-0936;AI-298/32906024

Chemical Property of 3-amino-6-methyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one

Chemical Property:

• PSA: 95.90000
• LogP: 0.50930
• XLogP3: -0.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 157.03098303
• Heavy Atom Count: 10
• Complexity: 223

Purity/Quality:

99% ^*data from raw suppliers

3-Amino-6-methyl-2-thioxo-2,3-dihydro-1H-pyrimidin-4-one ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=O)N(C(=S)N1)N