1-Butyl-2-{4-[2-(4-chlorophenyl)ethoxy]-phenyl}-6-(2-pyrrolidin-1-yl-ethoxy)-1h-benzimidazole
Basic information
- Standard SMILES
CCCCn1c(-c2ccc(OCCc3ccc(Cl)cc3)cc2)nc2ccc(OCCN3CCCC3)cc21- InChIKey
LOGZBGXEPUZDTC-UHFFFAOYSA-N- Molecular formula
- C31H36ClN3O2
- Average molar mass
- 518.1 g/mol
Names & identifiers
- Preferred name
- 1-Butyl-2-{4-[2-(4-chlorophenyl)ethoxy]-phenyl}-6-(2-pyrrolidin-1-yl-ethoxy)-1h-benzimidazole
- IUPAC
- 1-butyl-2-[4-[2-(4-chlorophenyl)ethoxy]phenyl]-6-(2-pyrrolidin-1-ylethoxy)benzimidazole
Names & synonyms
SCHEMBL1283281LOGZBGXEPUZDTC-UHFFFAOYSA-N1-butyl-2-{4-[2-(4-chlorophenyl)ethoxy]-phenyl}-6-(2-pyrrolidin-1-yl-ethoxy)-1h-benzimidazole
Database identifiers
- PubChem CID
- 59699134
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 39.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 12
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 646
Related reactions
3 records
Compound notes
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