Basic information
- Standard SMILES
N#Cc1ccc(-c2ccc(C3COC(c4c(F)cccc4F)=N3)cc2)cc1- InChIKey
VTVGDUWWFCRPFB-UHFFFAOYSA-N- Molecular formula
- C22H14F2N2O
- Average molar mass
- 360.4 g/mol
Names & identifiers
- Preferred name
- 4'-[2-(2,6-Difluorophenyl)-4,5-dihydro-4-oxazolyl][1,1'-biphenyl]-4-carbonitrile
- IUPAC
- 4-[4-[2-(2,6-difluorophenyl)-4,5-dihydro-1,3-oxazol-4-yl]phenyl]benzonitrile
Names & synonyms
SCHEMBL7837633VTVGDUWWFCRPFB-UHFFFAOYSA-N4'-[2-(2,6-Difluorophenyl)-4,5-dihydro-4-oxazolyl][1,1'-biphenyl]-4-carbonitrile
Database identifiers
- PubChem CID
- 19080127
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 45.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 574
Related reactions
2 records
Compound notes
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