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Ataluren

C15H9FN2O3CAS 775304-57-9284.25 g/mol

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OHONOFN
Aryl halideCarboxylic acid

Properties

Molecular formula
C15H9FN2O3
Molar mass
284.25 g/mol
Exact mass
284.0597 Da
logP
3.24Crippen estimate
Polar surface area
76.2 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
3

Identifiers

CAS number
775304-57-9
SMILES
O=C(O)c1cccc(-c2noc(-c3ccccc3F)n2)c1
InChIKey
OOUGLTULBSNHNF-UHFFFAOYSA-N
InChI
InChI=1S/C15H9FN2O3/c16-12-7-2-1-6-11(12)14-17-13(18-21-14)9-4-3-5-10(8-9)15(19)20/h1-8H,(H,19,20)

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Names and synonyms

5 names
  • Benzoic acid, 3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-
  • 3-[5-(2-Fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoic acid
  • PTC 124
  • PCT 124
  • Translarna

Work with Ataluren

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2'-Fluorobiphenyl-3-carboxylic acid103978-23-065 % similar 3′-Fluoro[1,1′-biphenyl]-3-carboxylic acid168619-04-347 % similar [1,1′-Biphenyl]-3-carboxylic acid716-76-747 % similar 4′-Fluoro[1,1′-biphenyl]-3-carboxylic acid10540-39-345 % similar 2′-Methoxy[1,1′-biphenyl]-3-carboxylic acid168618-47-144 % similar 3-Fluorobenzoic acid455-38-942 % similar 3′-Chloro[1,1′-biphenyl]-3-carboxylic acid168619-06-541 % similar Isophthalic acid121-91-540 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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