Basic information
- Standard SMILES
COc1cc(F)c(-c2ncc(Br)cn2)c(F)c1- InChIKey
NEBNZNHVCIHUSH-UHFFFAOYSA-N- Molecular formula
- C11H7BrF2N2O
- Average molar mass
- 301.09 g/mol
Names & identifiers
- Preferred name
- 5-Bromo-2-(2,6-difluoro-4-methoxyphenyl)pyrimidine
- IUPAC
- 5-bromo-2-(2,6-difluoro-4-methoxyphenyl)pyrimidine
Names & synonyms
SCHEMBL2404416NEBNZNHVCIHUSH-UHFFFAOYSA-N5-bromo-2-(2,6-difluoro-4-methoxyphenyl)pyrimidine
Database identifiers
- PubChem CID
- 67394249
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 35 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 240
Related reactions
4 records
Compound notes
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