Basic information
- Standard SMILES
Cc1nc(I)c(C)n1-c1cc(F)ncn1- InChIKey
CJIAGQZQWTTZGO-UHFFFAOYSA-N- Molecular formula
- C9H8FIN4
- Average molar mass
- 318.09 g/mol
- Monoisotopic mass
- 317.97777
Names & identifiers
- Preferred name
- 4-Fluoro-6-(4-iodo-2,5-dimethyl-imidazol-1-yl)-pyrimidine
- IUPAC
- 4-fluoro-6-(4-iodo-2,5-dimethylimidazol-1-yl)pyrimidine
Names & synonyms
SCHEMBL980053CJIAGQZQWTTZGO-UHFFFAOYSA-N4-fluoro-6-(4-iodo-2,5-dimethyl-imidazol-1-yl)-pyrimidine
Database identifiers
- PubChem CID
- 66865373
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 43.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 230
Related reactions
4 records
Compound notes
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