chempirical

Fluridone

C19H14F3NOCAS 59756-60-4329.32 g/mol

Open in Covalent MOL file
NOFFF
Alkyl halide

Properties

Molecular formula
C19H14F3NO
Molar mass
329.32 g/mol
Exact mass
329.1027 Da
Melting point
155 °C
logP
4.74Crippen estimate
Polar surface area
22.0 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Identifiers

CAS number
59756-60-4
SMILES
Cn1cc(-c2ccccc2)c(=O)c(-c2cccc(C(F)(F)F)c2)c1
InChIKey
YWBVHLJPRPCRSD-UHFFFAOYSA-N
InChI
InChI=1S/C19H14F3NO/c1-23-11-16(13-6-3-2-4-7-13)18(24)17(12-23)14-8-5-9-15(10-14)19(20,21)22/h2-12H,1H3

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Type any one amount. The others follow from the molar mass.

Names and synonyms

4 names
  • 4(1H)-Pyridinone, 1-methyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]-
  • 1-Methyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]-4(1H)-pyridinone
  • EL 171
  • Sonar

Work with Fluridone

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

1-Methyl-3-(trifluoromethyl)benzene401-79-640 % similar 3'-Trifluoromethylbiphenyl-3-carbaldehyde126091-24-540 % similar 3'-Trifluoromethylbiphenyl-4-carbaldehyde100036-64-440 % similar 3,5-Bis(trifluoromethyl)benzene402-31-339 % similar 3-(Trifluoromethyl)benzophenone728-81-438 % similar 3-(Trifluoromethyl)benzonitrile368-77-438 % similar Trifluorotoluene98-08-837 % similar 3-Fluorobenzotrifluoride401-80-936 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia