3-[4-(2-Trifluoromethyl-benzyloxy)-phenyl]-isoxazole-5-carboxylic acid amide

HCID 76280797
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Basic information

Standard SMILES
NC(=O)c1cc(-c2ccc(OCc3ccccc3C(F)(F)F)cc2)no1
InChIKey
KKJAUYFTYPDEFQ-UHFFFAOYSA-N
Molecular formula
C18H13F3N2O3
Average molar mass
362.3 g/mol

Names & identifiers

Preferred name
3-[4-(2-Trifluoromethyl-benzyloxy)-phenyl]-isoxazole-5-carboxylic acid amide
IUPAC
3-[4-[[2-(trifluoromethyl)phenyl]methoxy]phenyl]-1,2-oxazole-5-carboxamide

Names & synonyms

3-[4-(2-trifluoromethyl-benzyloxy)-phenyl]-isoxazole-5-carboxylic acid amideSCHEMBL15774775

Database identifiers

PubChem CID
76280797

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
78.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
26

Related reactions

1 records
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Compound notes

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