Basic information
- Standard SMILES
Fc1ccc(-c2nncc(-c3ccc(F)c(C(F)(F)F)c3)n2)c(F)c1- InChIKey
VLRKPSWHGFRHBM-UHFFFAOYSA-N- Molecular formula
- C16H7F6N3
- Average molar mass
- 355.24 g/mol
Names & identifiers
- Preferred name
- 3-(2,4-Difluorophenyl)-5-(4-fluoro-3-trifluoromethylphenyl)-[1,2,4]triazine
- IUPAC
- 3-(2,4-difluorophenyl)-5-[4-fluoro-3-(trifluoromethyl)phenyl]-1,2,4-triazine
Names & synonyms
3-(2,4-difluorophenyl)-5-(4-fluoro-3-trifluoromethylphenyl)-[1,2,4]triazineSCHEMBL2644388
Database identifiers
- PubChem CID
- 10450834
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 448
Related reactions
1 records
Compound notes
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