Basic information
- Standard SMILES
CC(C)(O)c1ccn2c(-c3cc(F)cc(-c4ccc(F)cc4C#N)c3)cnc2c1F- InChIKey
NDUVXXZAAFRRAS-UHFFFAOYSA-N- Molecular formula
- C23H16F3N3O
- Average molar mass
- 407.4 g/mol
- Monoisotopic mass
- 407.12454663
Names & identifiers
- Preferred name
- 4,3'-Difluoro-5'-[8-fluoro-7-(1-hydroxy-1-methylethyl)imidazo[1,2-alpha]pyridin-3-yl]-biphenyl-2-carbonitrile
- IUPAC
- 5-fluoro-2-[3-fluoro-5-[8-fluoro-7-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]benzonitrile
Names & synonyms
SCHEMBL2659881NDUVXXZAAFRRAS-UHFFFAOYSA-N4,3'-difluoro-5'-[8-fluoro-7-(1-hydroxy-1-methylethyl)imidazo[1,2-alpha]pyridin-3-yl]-biphenyl-2-carbonitrile
Database identifiers
- PubChem CID
- 10431508
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 61.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 667
Related reactions
1 records
Compound notes
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