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2-[(3-phenoxyphenyl)methylsulfanyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole (HCID 68569015)|Huagongshe
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Compound
2-[(3-phenoxyphenyl)methylsulfanyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
HCID
68569015
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
c1ccc(Oc2cccc(CSC3=NC(c4ccccc4)C(c4ccccc4)N3)c2)cc1
InChIKey
RREDGSRLNNYXCB-UHFFFAOYSA-N
Molecular formula
C28H24N2OS
Average molar mass
436.6 g/mol
Names & identifiers
Preferred name
2-[(3-phenoxyphenyl)methylsulfanyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
IUPAC
2-[(3-phenoxyphenyl)methylsulfanyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
Names & synonyms
SCHEMBL3254990
Database identifiers
PubChem CID
68569015
Properties
Computed structural properties
XLogP
6.4
Topological polar surface area
58.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
32
Formal charge
0
Complexity
592
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Related reactions
1 records
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As reactant
As product
As reagent
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As solvent
HRID
108040
As product
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Compound notes
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