Ataluren
3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoic acid
Molecular Identity
Ataluren
3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoic acid
PubChem CID: 11219835
3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoic acid is a ring assembly and an oxadiazole.
2D Structure
Properties
C15H9FN2O3
Molecular Formula
284.24
Molecular Weight
g/mol
284.0597
Exact Mass
Da
3.1
XLogP
Drug-like (Lipinski: < 5)
76.2
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
6
H-Bond Acceptors
382
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC=C(C(=C1)C2=NC(=NO2)C3=CC(=CC=C3)C(=O)O)FIsomeric SMILES
SMILES: C1=CC=C(C(=C1)C2=NC(=NO2)C3=CC(=CC=C3)C(=O)O)FSynonyms(20)
Ataluren775304-57-9PTC124PTC-1243-[5-(2-Fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoic acid3-(5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl)benzoic acidTranslarnaK16AME9I3VAtalurenoDTXSID5046776Benzoic acid, 3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-DTXCID3026776Benzoic acid, 3-(5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl)-atalurenumRefChem:560297
Data from PubChem (NCBI)
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