Basic information
- Standard SMILES
CCc1cc2c(Cl)ccc(-n3c(=O)cc(C(F)(F)F)n(C)c3=O)c2o1- InChIKey
FTKINIONURYBDT-UHFFFAOYSA-N- Molecular formula
- C16H12ClF3N2O3
- Average molar mass
- 372.72 g/mol
- Monoisotopic mass
- 372.0488544
Names & identifiers
- Preferred name
- 3-(4-Chloro-2-ethylbenzofuran-7-yl)-1-methyl-6-trifluoromethyluracil
- IUPAC
- 3-(4-chloro-2-ethyl-1-benzofuran-7-yl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione
Names & synonyms
3-(4-chloro-2-ethylbenzofuran-7-yl)-1-methyl-6-trifluoromethyluracilSCHEMBL8175037
Database identifiers
- PubChem CID
- 23289166
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 53.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 610
Related reactions
1 records
Compound notes
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