Basic information
- Standard SMILES
COc1ncc(-c2cc(F)cnc2Cl)c(OC)n1- InChIKey
REOVDKKXTXRCKT-UHFFFAOYSA-N- Molecular formula
- C11H9ClFN3O2
- Average molar mass
- 269.66 g/mol
- Monoisotopic mass
- 269.0367324
Names & identifiers
- Preferred name
- 5-(2-Chloro-5-fluoro-pyridin-3-yl)-2,4-dimethoxy-pyrimidine
- IUPAC
- 5-(2-chloro-5-fluoro-3-pyridinyl)-2,4-dimethoxypyrimidine
Names & synonyms
SCHEMBL3562866REOVDKKXTXRCKT-UHFFFAOYSA-N5-(2-Chloro-5-fluoro-pyridin-3-yl)-2,4-dimethoxy-pyrimidine
Database identifiers
- PubChem CID
- 58994239
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 57.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 275
Related reactions
3 records
Compound notes
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