4-Bromo-6-chloro-1H-pyrrolo[2,3-b]pyridine

C7H4BrClN2CAS 942920-50-5231.48 g/mol

Open in Covalent MOL file
HNNClBr
Aryl halide

Properties

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

Hazards

Warning
Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
942920-50-5
SMILES
C1=CNC2=C1C(=CC(=N2)Cl)Br
InChIKey
OATRMIWUNLJMJV-UHFFFAOYSA-N
InChI
InChI=1S/C7H4BrClN2/c8-5-3-6(9)11-7-4(5)1-2-10-7/h1-3H,(H,10,11)

Weigh it out

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Names and synonyms

1 names
  • 1H-Pyrrolo[2,3-B]pyridine, 4-bromo-6-chloro-

Work with 4-Bromo-6-chloro-1H-pyrrolo[2,3-b]pyridine

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

4,6-Dichloro-1H-pyrrolo[2,3-b]pyridine5912-18-564 % similar 4-Bromo-1H-pyrrolo[2,3-b]pyridine348640-06-249 % similar 4,6-Dichloro-1H-pyrrolo[3,2-c]pyridine67139-79-146 % similar 6-Chloro-1H-pyrrolo[2,3-B]pyridine55052-27-246 % similar 4-Chloro-2-methyl-7H-pyrrolo[2,3-d]pyrimidine71149-52-541 % similar 2-Amino-4-chloropyrrolo[2,3-D]pyrimidine84955-31-741 % similar 2-Chloro-5H-pyrrolo[2,3-B]pyrazine889447-19-241 % similar 4-Bromoindole52488-36-540 % 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-indazole1082041-90-4 5-Bromo-3-chloro-1H-indazole36760-19-7 5-Bromo-7-chloro-1H-indazole635712-44-6 5-Bromo-4-chloro-1H-pyrrolo[2,3-b]pyridine876343-82-7 4-Bromo-6-chloro-1H-indazole885519-03-9 6-Chloro-3-bromo-imidazo[1,2-A]pyridine886371-28-4

Elsewhere

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