N-methyl-6-(methylamino)-2-methylsulfanylpyrimidine-4-carboxamide
Basic information
- CAS
6307-58-0- Standard SMILES
CNC(=O)c1cc(NC)nc(SC)n1- InChIKey
QMSZVZSJWHAJKL-UHFFFAOYSA-N- Molecular formula
- C8H12N4OS
- Average molar mass
- 212.27 g/mol
- Monoisotopic mass
- 212.07318219
Names & identifiers
- Preferred name
- N-methyl-6-(methylamino)-2-methylsulfanylpyrimidine-4-carboxamide
- IUPAC
- N-methyl-6-(methylamino)-2-methylsulfanylpyrimidine-4-carboxamide
Names & synonyms
6307-58-0NSC44200DTXSID40979009NSC-44200N-Methyl-6-(methylimino)-2-(methylsulfanyl)-1,6-dihydropyrimidine-4-carboximidic acid
Database identifiers
- CAS
6307-58-0- PubChem CID
- 239278
- DTXSID
DTXSID40979009
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 92.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 202
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Compound notes
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