5-(3,4-Dichlorophenyl)-3-(pyridin-3-yl)isoxazole

HCID 44546158
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Basic information

Standard SMILES
Clc1ccc(-c2cc(-c3cccnc3)no2)cc1Cl
InChIKey
MFLRLOUSOWXQHA-UHFFFAOYSA-N
Molecular formula
C14H8Cl2N2O
Average molar mass
291.1 g/mol
Monoisotopic mass
290.0013683

Names & identifiers

Preferred name
5-(3,4-Dichlorophenyl)-3-(pyridin-3-yl)isoxazole
IUPAC
5-(3,4-dichlorophenyl)-3-pyridin-3-yl-1,2-oxazole

Names & synonyms

SCHEMBL4331772MFLRLOUSOWXQHA-UHFFFAOYSA-N5-(3,4-Dichlorophenyl)-3-(pyridin-3-yl)isoxazole

Database identifiers

PubChem CID
44546158

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
38.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
19

Related reactions

1 records
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Compound notes

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