Basic information
- Standard SMILES
N#Cc1ccc(CC(C#N)N=C(c2ccccc2)c2ccccc2)c(F)c1- InChIKey
RCFRNUITFRXTCO-UHFFFAOYSA-N- Molecular formula
- C23H16FN3
- Average molar mass
- 353.4 g/mol
Names & identifiers
- Preferred name
- 4-{2-Cyano-2-[(diphenylmethylene)amino]ethyl}-3-fluorobenzonitrile
- IUPAC
- 4-[2-(benzhydrylideneamino)-2-cyanoethyl]-3-fluorobenzonitrile
Names & synonyms
SCHEMBL2926975RCFRNUITFRXTCO-UHFFFAOYSA-N4-{2-cyano-2-[(diphenylmethylene)amino]ethyl}-3-fluorobenzonitrile4{2-cyano-2-[(diphenylmethylene)amino]ethyl}-3-fluorobenzonitrile
Database identifiers
- PubChem CID
- 86648145
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 59.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 578
Related reactions
2 records
Compound notes
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