Basic information
- Standard SMILES
N#Cc1ccc(Cn2c(-c3ccc(Cl)cc3O)nc3ccccc32)c(F)c1- InChIKey
WHDNOOJNVVRVLY-UHFFFAOYSA-N- Molecular formula
- C21H13ClFN3O
- Average molar mass
- 377.8 g/mol
Names & identifiers
- Preferred name
- 4-[2-(4-Chloro-2-hydroxy-phenyl)-benzoimidazol-1-ylmethyl]-3-fluoro-benzonitrile
- IUPAC
- 4-[[2-(4-chloro-2-hydroxyphenyl)benzimidazol-1-yl]methyl]-3-fluorobenzonitrile
Names & synonyms
SCHEMBL1482083WHDNOOJNVVRVLY-UHFFFAOYSA-N4-[2-(4-chloro-2-hydroxy-phenyl)-benzoimidazol-1-ylmethyl]-3-fluoro-benzonitrile
Database identifiers
- PubChem CID
- 136378475
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 569
Related reactions
2 records
Compound notes
Loading…