4'-[[2-n-Propyl-4-methyl-6-(1-ethyl-4,5-dimethyl-imidazol-2-yl)-1H-benzimidazol-1-yl]-methyl]-biphenyl-2-carboxylic Acid

HCID 54547640

Basic information

Standard SMILES
CCCc1nc2c(C)cc(-c3nc(C)c(C)n3CC)cc2n1Cc1ccc(-c2ccccc2C(=O)O)cc1
InChIKey
ZHQWUADHUOBGMT-UHFFFAOYSA-N
Molecular formula
C32H34N4O2
Average molar mass
506.6 g/mol

Names & identifiers

Preferred name
4'-[[2-n-Propyl-4-methyl-6-(1-ethyl-4,5-dimethyl-imidazol-2-yl)-1H-benzimidazol-1-yl]-methyl]-biphenyl-2-carboxylic Acid
IUPAC
2-[4-[[6-(1-ethyl-4,5-dimethylimidazol-2-yl)-4-methyl-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoic acid

Names & synonyms

SCHEMBL8847950ZHQWUADHUOBGMT-UHFFFAOYSA-N4'-[[2-n-Propyl-4-methyl-6-(1-ethyl-4,5-dimethyl-imidazol-2-yl)-1H-benzimidazol-1-yl]-methyl]-biphenyl-2-carboxylic Acid

Database identifiers

PubChem CID
54547640

Properties

Computed structural properties

XLogP
6.6
Topological polar surface area
72.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
38

Related reactions

4 records

Compound notes

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