chempirical

Senicapoc

C20H15F2NOCAS 289656-45-7323.34 g/mol

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H2NOFF
Aryl halide

Properties

Molecular formula
C20H15F2NO
Molar mass
323.34 g/mol
Exact mass
323.1122 Da
Melting point
180–181 °C
logP
4.83Crippen estimate
Polar surface area
44.1 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
4

Identifiers

CAS number
289656-45-7
SMILES
N=C(O)C(c1ccccc1)(c1ccc(F)cc1)c1ccc(F)cc1
InChIKey
SCTZUZTYRMOMKT-UHFFFAOYSA-N
InChI
InChI=1S/C20H15F2NO/c21-17-10-6-15(7-11-17)20(19(23)24,14-4-2-1-3-5-14)16-8-12-18(22)13-9-16/h1-13H,(H2,23,24)

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Names and synonyms

4 names
  • Benzeneacetamide, 4-fluoro-α-(4-fluorophenyl)-α-phenyl-
  • 4-Fluoro-α-(4-fluorophenyl)-α-phenylbenzeneacetamide
  • ICA 17043
  • 2,2-Bis(4-fluorophenyl)-2-phenylacetamide

Work with Senicapoc

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

Phenylethylmalonamide7206-76-045 % similar Triphenylacetic acid595-91-541 % similar 4-Fluorobiphenyl324-74-338 % similar Aminopentamide60-46-837 % similar 4-Fluorobenzotrifluoride402-44-836 % similar 1,2,2,2-Tetraphenylethanone466-37-536 % similar Imidafenacin170105-16-535 % similar 1-Fluoro-4-(trichloromethyl)benzene402-42-635 % similar

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

Elsewhere

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