chempirical

5-Bromo-7-methyl-1H-indazole

C8H7BrN2CAS 156454-43-2211.06 g/mol

Open in Covalent MOL file
HNNBr
Aryl halide

Properties

Molecular formula
C8H7BrN2
Molar mass
211.06 g/mol
Exact mass
209.9793 Da
logP
2.63Crippen estimate
Polar surface area
28.7 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
156454-43-2
SMILES
CC1=CC(=CC2=C1NN=C2)Br
InChIKey
OUNQFZFHLJLFAR-UHFFFAOYSA-N
InChI
InChI=1S/C8H7BrN2/c1-5-2-7(9)3-6-4-10-11-8(5)6/h2-4H,1H3,(H,10,11)

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Work with 5-Bromo-7-methyl-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-2-iodo-1,3-dimethylbenzene206559-43-541 % similar 2,5-Dibromo-3-methylpyridine3430-18-040 % similar 4-Bromo-2,6-dimethylphenol2374-05-239 % similar 4-Bromo-2,6-dimethylbenzenamine24596-19-839 % similar 6-Bromo-4-iodo-1H-indazole885519-41-538 % similar 5-Bromo-3-methyl-2(1H)-pyridinone89488-30-238 % similar 4-Bromo-2-methylphenol2362-12-136 % similar 6-Bromo-4-fluoro-1H-indazole885520-23-035 % similar

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

Same formula

6-Bromo-5-methyl (1H)indazole1000343-69-0 7-Bromo-1-methyl-1H-indazole1000576-59-9 5-Bromo-4-methyl-1H-indazole1082041-34-6 5-Bromo-3-methyl-7-azaindole1111637-94-5 2-Methyl-5-bromo-7-azaindole1111638-02-8 7-Bromo-3-methyl-1H-indazole1159511-75-7 4-Bromo-1-methyl-1H-1,3-benzodiazole1353679-63-6 5-Bromo-2-methyl-2H-indazole465529-56-0

Elsewhere

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