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Compound
3-(2-Chloro-5-fluoro-4-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
HCID
124155334
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Basic information
Standard SMILES
Fc1cnc(Cl)cc1-c1cnn2c1CCCC2
InChIKey
YQEVNNXZEKRMBM-UHFFFAOYSA-N
Molecular formula
C12H11ClFN3
Average molar mass
251.69 g/mol
Names & identifiers
Preferred name
3-(2-Chloro-5-fluoro-4-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
IUPAC
3-(2-chloro-5-fluoro-4-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
Names & synonyms
SCHEMBL18338565
Database identifiers
PubChem CID
124155334
Properties
Computed structural properties
XLogP
2.6
Topological polar surface area
30.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
17
Formal charge
0
Complexity
278
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HRID
598
As reactant
750 AstraZeneca ELN dataset
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