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Basic information
- Standard SMILES
N#Cc1cc(F)ccc1-c1cc(-c2ccnc3nc(C(F)(F)F)ccc23)ccc1F- InChIKey
ZYFFIFZOSSVMQH-UHFFFAOYSA-N- Molecular formula
- C22H10F5N3
- Average molar mass
- 411.3 g/mol
Names & identifiers
- Preferred name
- 4,2'-Difluoro-5'-(7-trifluoromethyl-[1,8]naphthyridin-4-yl)biphenyl-2-carbonitrile
- IUPAC
- 5-fluoro-2-[2-fluoro-5-[7-(trifluoromethyl)-1,8-naphthyridin-4-yl]phenyl]benzonitrile
Names & synonyms
4,2'-difluoro-5'-(7-trifluoromethyl-[1,8]naphthyridin-4-yl)biphenyl-2-carbonitrileSCHEMBL2650079
Database identifiers
- PubChem CID
- 10201664
Properties
Computed structural propertiesFilling in
- XLogP
- 5.5
- Topological polar surface area
- 49.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 646
Related reactions
2 records
Compound notes
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