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1,4-Dibenzyl-2-[2-[4-(trifluoromethyl)phenyl]ethyl]piperazine (HCID 21093620)|Huagongshe
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Compound
1,4-Dibenzyl-2-[2-[4-(trifluoromethyl)phenyl]ethyl]piperazine
HCID
21093620
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
FC(F)(F)c1ccc(CCC2CN(Cc3ccccc3)CCN2Cc2ccccc2)cc1
InChIKey
XLCCSIMRKWGGNX-UHFFFAOYSA-N
Molecular formula
C27H29F3N2
Average molar mass
438.5 g/mol
Names & identifiers
Preferred name
1,4-Dibenzyl-2-[2-[4-(trifluoromethyl)phenyl]ethyl]piperazine
IUPAC
1,4-dibenzyl-2-[2-[4-(trifluoromethyl)phenyl]ethyl]piperazine
Names & synonyms
SCHEMBL5557142
Database identifiers
PubChem CID
21093620
Properties
Computed structural properties
XLogP
6.3
Topological polar surface area
6.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
32
Formal charge
0
Complexity
532
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Related reactions
1 records
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As solvent
HRID
1138972
As product
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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