1-ethyl-6-(4-fluorophenyl)-4-(5-methyl-3-pyridyl)-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile

HCID 69184792
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Basic information

Standard SMILES
CCn1ncc2c(-c3cncc(C)c3)c(C#N)c(-c3ccc(F)cc3)nc21
InChIKey
ARMJECUIIZHVHY-UHFFFAOYSA-N
Molecular formula
C21H16FN5
Average molar mass
357.4 g/mol
Monoisotopic mass
357.13897369

Names & identifiers

Preferred name
1-ethyl-6-(4-fluorophenyl)-4-(5-methyl-3-pyridyl)-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
IUPAC
1-ethyl-6-(4-fluorophenyl)-4-(5-methyl-3-pyridinyl)pyrazolo[3,4-b]pyridine-5-carbonitrile

Names & synonyms

SCHEMBL4776347ARMJECUIIZHVHY-UHFFFAOYSA-N1-ethyl-6-(4-fluorophenyl)-4-(5-methyl-3-pyridyl)-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile

Database identifiers

PubChem CID
69184792

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
67.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
27

Related reactions

2 records
New reaction record

Linked notes

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