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8-(2-Methyl-4,5-diphenylimidazol-1-yl)octanoic acid (HCID 10248966)|Huagongshe
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Compound
8-(2-Methyl-4,5-diphenylimidazol-1-yl)octanoic acid
HCID
10248966
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
Cc1nc(-c2ccccc2)c(-c2ccccc2)n1CCCCCCCC(=O)O
InChIKey
MKBWLFNKDKSMMC-UHFFFAOYSA-N
Molecular formula
C24H28N2O2
Average molar mass
376.5 g/mol
Monoisotopic mass
376.21507814
Names & identifiers
Preferred name
8-(2-Methyl-4,5-diphenylimidazol-1-yl)octanoic acid
IUPAC
8-(2-methyl-4,5-diphenylimidazol-1-yl)octanoic acid
Names & synonyms
CHEMBL117685
SCHEMBL5378409
Database identifiers
PubChem CID
10248966
ChEMBL
CHEMBL117685
Nikkaji
J512.059D
Properties
Computed structural properties
XLogP
5.3
Topological polar surface area
55.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
10
Heavy atoms
28
Formal charge
0
Complexity
458
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Related reactions
1 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
2160535
As product
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Compound notes
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