5-Bromo-4-chloro-1H-indazole

C₇H₄BrClN₂CAS 1082041-90-4231.48 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₄BrClN₂
Molar mass: 231.48 g/mol
Exact mass: 229.9246 Da
logP: 2.98Crippen estimate
Polar surface area: 28.7 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Identifiers

CAS number

1082041-90-4

SMILES

C1=CC(=C(C2=C1NN=C2)Cl)Br

InChIKey

GMGRNRQBEWCLKJ-UHFFFAOYSA-N

InChI

InChI=1S/C7H4BrClN2/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-chloro-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-fluoro-1H-indazole1082041-85-759 % similar 4-Bromo-1H-pyrazolo[3,4-C]pyridine1032943-43-347 % similar 4-Chloro (1H)indazole13096-96-347 % similar 4-Bromo-6-fluoro-1H-indazole885520-35-442 % similar 1H-Indazole-4-carboxaldehyde669050-70-838 % similar 5-Chloro-1H-indazole698-26-038 % similar 4-Bromo-2,3-dichlorobenzenamine56978-48-437 % similar 1-Bromo-2,3-dichlorobenzene56961-77-436 % similar

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

Same formula

3-Bromo-4-chloro-1H-pyrrolo[2,3-B]pyridine1000340-39-5 5-Bromo-4-chloro-1H-pyrrolo[2,3-B]pyridine876343-82-7 4-Bromo-6-chloro-1H-indazole885519-03-9

Elsewhere

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