Basic information
- Standard SMILES
O=Cc1ccc(-c2noc(-c3nnn(-c4ccccc4F)c3-c3ccncc3)n2)cc1- InChIKey
ZHDMEAPQDFEPLD-UHFFFAOYSA-N- Molecular formula
- C22H13FN6O2
- Average molar mass
- 412.4 g/mol
Names & identifiers
- Preferred name
- 4-(5-(1-(2-fluorophenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazol-3-yl) benzaldehyde
- IUPAC
- 4-[5-[1-(2-fluorophenyl)-5-pyridin-4-yltriazol-4-yl]-1,2,4-oxadiazol-3-yl]benzaldehyde
Names & synonyms
SCHEMBL3455575ZHDMEAPQDFEPLD-UHFFFAOYSA-N4-(5-(1-(2-fluorophenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazol-3-yl) benzaldehyde4-(5-(1-(2-fluorophenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazol-3-yl)benzaldehyde
Database identifiers
- PubChem CID
- 86648159
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 99.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 601
Related reactions
50 records
Compound notes
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