3-Iodo-1H-pyrazolo(3,4-b)pyridine

C₆H₄IN₃CAS 117007-52-0245.02 g/mol

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Properties

Molecular formula: C₆H₄IN₃
Molar mass: 245.02 g/mol
Exact mass: 244.9450 Da
logP: 1.56Crippen estimate
Polar surface area: 41.6 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Identifiers

CAS number

117007-52-0

SMILES

C1=CC2=C(NN=C2N=C1)I

InChIKey

TYXAGVKIICJXGF-UHFFFAOYSA-N

InChI

InChI=1S/C6H4IN3/c7-5-4-2-1-3-8-6(4)10-9-5/h1-3H,(H,8,9,10)

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Names and synonyms

1 names

3-Iodo-7-aza-1H-azaindazole

Work with 3-Iodo-1H-pyrazolo(3,4-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

1H-Pyrazolo[3,4-B]pyridine,3-methyl-(9ci)116834-96-956 % similar 1H-Pyrazolo[3,4-B]pyridine-3-carboxylicacid(9ci)116855-08-447 % similar 5-Bromo-3-iodo-1H-pyrazolo[3,4-B]pyridine875781-18-347 % similar 1,8-Naphthyridine254-60-438 % similar Pyrido[2,3-B]pyrazine322-46-335 % similar 2,4-Dichloro-pyrido[2,3-d]pyrimidine126728-20-935 % similar 3-Methyl-1H-pyrrolo[2,3-B]pyridine5654-93-335 % similar 9H-Pyrido[2,3-B]indole244-76-833 % similar

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

Elsewhere

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