Basic information
- Standard SMILES
O=C(Nc1ccc(OC(F)(F)F)cc1)c1cncc(-c2cncc(F)c2)c1- InChIKey
HZUSSBYGSRREPT-UHFFFAOYSA-N- Molecular formula
- C18H11F4N3O2
- Average molar mass
- 377.3 g/mol
- Monoisotopic mass
- 377.07873925
Names & identifiers
- Preferred name
- 5'-Fluoro-N-(4-(trifluoromethoxy)phenyl)-[3,3'-bipyridine]-5-carboxamide
- IUPAC
- 5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
Names & synonyms
5'-Fluoro-N-(4-(trifluoromethoxy)phenyl)-[3,3'-bipyridine]-5-carboxamideCHEMBL3958784SCHEMBL16714107BDBM222539US9315489, 75
Database identifiers
- PubChem CID
- 72201585
- ChEMBL
CHEMBL3958784
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 64.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 497
Related reactions
1 records
Compound notes
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