4-Fluoro-3-(4-trifluoromethylphenoxy)benzyl 2-(2-chloro-4-trifluoromethylphenylamino)-3-methylbutanoate

HCID 53672736
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Basic information

Standard SMILES
CC(C)C(Nc1ccc(C(F)(F)F)cc1Cl)C(=O)OCc1ccc(F)c(Oc2ccc(C(F)(F)F)cc2)c1
InChIKey
BAZXFWOZPLIJKA-UHFFFAOYSA-N
Molecular formula
C26H21ClF7NO3
Average molar mass
563.9 g/mol

Names & identifiers

Preferred name
4-Fluoro-3-(4-trifluoromethylphenoxy)benzyl 2-(2-chloro-4-trifluoromethylphenylamino)-3-methylbutanoate
IUPAC
[4-fluoro-3-[4-(trifluoromethyl)phenoxy]phenyl]methyl 2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate

Names & synonyms

4-fluoro-3-(4-trifluoromethylphenoxy)benzyl 2-(2-chloro-4-trifluoromethylphenylamino)-3-methylbutanoateSCHEMBL11496386

Database identifiers

PubChem CID
53672736

Properties

Computed structural properties

XLogP
8.7
Topological polar surface area
47.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
11
Rotatable bonds
9
Heavy atoms
38

Related reactions

1 records
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Compound notes

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