7-Chloro-2-(1,1-dimethylethyl)-5-(trifluoromethyl)pyrazolo[1,5-A]pyrimidine

C₁₁H₁₁ClF₃N₃CAS 175203-38-0277.68 g/mol

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Alkyl halide Aryl halide

Properties

Molecular formula: C₁₁H₁₁ClF₃N₃
Molar mass: 277.68 g/mol
Exact mass: 277.0594 Da
logP: 3.70Crippen estimate
Polar surface area: 30.2 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Identifiers

CAS number

175203-38-0

SMILES

CC(C)(C)c1cc2nc(C(F)(F)F)cc(Cl)n2n1

InChIKey

VYAQQNNHHQAUEL-UHFFFAOYSA-N

InChI

InChI=1S/C11H11ClF3N3/c1-10(2,3)6-5-9-16-7(11(13,14)15)4-8(12)18(9)17-6/h4-5H,1-3H3

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Names and synonyms

1 names

Pyrazolo[1,5-a]pyrimidine, 7-chloro-2-(1,1-dimethylethyl)-5-(trifluoromethyl)-

Work with 7-Chloro-2-(1,1-dimethylethyl)-5-(trifluoromethyl)pyrazolo[1,5-A]pyrimidine

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

4-(1,1-Dimethylethyl)-6-(trifluoromethyl)-2-pyrimidinamine238742-83-136 % similar 4-[6-(1,1-Dimethylethyl)-3H-pyrazolo[1,5-B][1,2,4]triazol-2-yl]benzenamine152828-25-632 % similar 4,5,7-Trichloro-2-(trifluoromethyl)quinoline175203-41-532 % similar 4-Chloro-6-methyl-2-(trifluoromethyl)quinoline1701-26-431 % similar 7-Chloro-2-(trifluoromethyl)-4-quinolinol57124-20-631 % similar 2-Chloro-6-(trifluoromethyl)isonicotinonitrile1196155-38-031 % similar 3-(1,1-Dimethylethyl)-1-methyl-1H-pyrazol-5-amine118430-73-231 % similar 2,6-Di-tert-butylpyridine585-48-831 % similar

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

Elsewhere

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