Basic information
- Standard SMILES
Cc1nc(Cl)c(F)c(NCc2csc(N)n2)n1- InChIKey
GKENWGMTCBECMP-UHFFFAOYSA-N- Molecular formula
- C9H9ClFN5S
- Average molar mass
- 273.72 g/mol
Names & identifiers
- Preferred name
- N-[(2-amino-1,3-thiazol-4-yl)methyl]-6-chloro-5-fluoro-2-methyl-4-pyrimidinamine
- IUPAC
- 4-[[(6-chloro-5-fluoro-2-methylpyrimidin-4-yl)amino]methyl]-1,3-thiazol-2-amine
Names & synonyms
SCHEMBL1190133GKENWGMTCBECMP-UHFFFAOYSA-NN-[(2-amino-1,3-thiazol-4-yl)methyl]-6-chloro-5-fluoro-2-methyl-4-pyrimidinamine
Database identifiers
- PubChem CID
- 86636959
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 262
Related reactions
4 records
Compound notes
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