Basic information
- Standard SMILES
CCCCn1c(-c2ccc(OCCc3ccc(Cl)cc3)cc2)nc2c(OCCCN(CC)CC)cc(OCCCN(CC)CC)cc21- InChIKey
SPMUFRMZFBZEKL-UHFFFAOYSA-N- Molecular formula
- C39H55ClN4O3
- Average molar mass
- 663.3 g/mol
Names & identifiers
- Preferred name
- (3-(1-Butyl-2-{4-[2-(4-chlorophenyl)-ethoxy]-phenyl}-6-(3-diethylaminopropoxy)-1h-benzimidazole-4-yloxy)-propyl)diethyl-amine
- IUPAC
- 3-[3-butyl-2-[4-[2-(4-chlorophenyl)ethoxy]phenyl]-7-[3-(diethylamino)propoxy]benzimidazol-5-yl]oxy-N,N-diethylpropan-1-amine
Names & synonyms
SCHEMBL1284125SPMUFRMZFBZEKL-UHFFFAOYSA-N(3-(1-butyl-2-{4-[2-(4-chlorophenyl)-ethoxy]-phenyl}-6-(3-diethylaminopropoxy)-1h-benzimidazole-4-yloxy)-propyl)diethyl-amine
Database identifiers
- PubChem CID
- 59699247
Properties
Computed structural properties
- XLogP
- 9
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 22
- Heavy atoms
- 47
- Formal charge
- 0
- Complexity
- 801
Related reactions
2 records
Compound notes
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