4-(3-(Pyridin-3-yl)isoxazol-5-yl)benzonitrile

HCID 44546161
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Basic information

Standard SMILES
N#Cc1ccc(-c2cc(-c3cccnc3)no2)cc1
InChIKey
WKJWTUSGNVZMIW-UHFFFAOYSA-N
Molecular formula
C15H9N3O
Average molar mass
247.25 g/mol

Names & identifiers

Preferred name
4-(3-(Pyridin-3-yl)isoxazol-5-yl)benzonitrile
IUPAC
4-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzonitrile

Names & synonyms

SCHEMBL4325945WKJWTUSGNVZMIW-UHFFFAOYSA-N4-(3-(Pyridin-3-yl)isoxazol-5-yl)benzonitrile

Database identifiers

PubChem CID
44546161

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
62.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
19

Related reactions

1 records
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Compound notes

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