Basic information
- Standard SMILES
COCc1c(F)c(F)c(COC(=O)C(c2cnc(C)nc2)C(C)(C)C)c(F)c1F- InChIKey
JFBODNBBIWZTKG-UHFFFAOYSA-N- Molecular formula
- C20H22F4N2O3
- Average molar mass
- 414.4 g/mol
Names & identifiers
- Preferred name
- 2,3,5,6-tetrafluoro-4-(methoxymethyl)benzyl (RS)-2-(2-methylpyrimidin-5-yl)-3,3-dimethylbutanoate
- IUPAC
- [2,3,5,6-tetrafluoro-4-(methoxymethyl)phenyl]methyl 3,3-dimethyl-2-(2-methylpyrimidin-5-yl)butanoate
Names & synonyms
JFBODNBBIWZTKG-UHFFFAOYSA-N2,3,5,6-tetrafluoro-4-(methoxymethyl)benzyl (RS)-2-(2-methylpyrimidin-5-yl)-3,3-dimethylbutanoate
Database identifiers
- PubChem CID
- 14718773
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 61.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 524
Related reactions
3 records
Compound notes
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