Basic information
- Standard SMILES
COCCCCn1c(C(Cl)(Cl)Cl)nc2ccc(F)cc21- InChIKey
AJCVLAFYBODSMK-UHFFFAOYSA-N- Molecular formula
- C13H14Cl3FN2O
- Average molar mass
- 339.6 g/mol
Names & identifiers
- Preferred name
- 6-fluoro-1-(4-methoxybutyl)-2-(trichloromethyl)-1H-benzimidazole
- IUPAC
- 6-fluoro-1-(4-methoxybutyl)-2-(trichloromethyl)benzimidazole
Names & synonyms
SCHEMBL1422405AJCVLAFYBODSMK-UHFFFAOYSA-N6-fluoro-1-(4-methoxybutyl)-2-(trichloromethyl)-1H-benzimidazole
Database identifiers
- PubChem CID
- 58355397
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 27.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 316
Related reactions
13 records
Compound notes
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