chempirical

5-Bromo-4-fluoro-1H-indazole

C7H4BrFN2CAS 1082041-85-7215.03 g/mol

Open in Covalent MOL file
HNNFBr
Aryl halide

Properties

Molecular formula
C7H4BrFN2
Molar mass
215.03 g/mol
Exact mass
213.9542 Da
logP
2.46Crippen estimate
Polar surface area
28.7 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
1082041-85-7
SMILES
C1=CC(=C(C2=C1NN=C2)F)Br
InChIKey
YJOQUFUSNSCGHN-UHFFFAOYSA-N
InChI
InChI=1S/C7H4BrFN2/c8-5-1-2-6-4(7(5)9)3-10-11-6/h1-3H,(H,10,11)

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Work with 5-Bromo-4-fluoro-1H-indazole

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

5-Bromo-4-chloro-1H-indazole1082041-90-459 % similar 4-Bromo-1H-pyrazolo[3,4-C]pyridine1032943-43-347 % similar 4-Bromo-6-chloro-1H-indazole885519-03-942 % similar 4-Chloro (1H)indazole13096-96-339 % similar 5-Fluoro-1H-indazole348-26-538 % similar 4-Bromo-2,3-difluorobenzenamine112279-72-837 % similar 4-Bromo-1H-indazole-6-carboxylic acid885523-43-336 % similar 1-Bromo-2,3-difluorobenzene38573-88-535 % similar

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

Same formula

5-Bromo-6-fluoro-1H-indazole105391-70-6 6-Bromo-5-fluoro-1H-indazole1286734-85-7 6-Bromo-4-fluoro-1H-indazole885520-23-0 4-Bromo-6-fluoro-1H-indazole885520-35-4

Elsewhere

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