5-(3-Chlorophenyl)-3-(5-chloropyridin-3-yl)isoxazole

HCID 44545546
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Basic information

Standard SMILES
Clc1cncc(-c2cc(-c3cccc(Cl)c3)on2)c1
InChIKey
OEFJPRAPEPYOBZ-UHFFFAOYSA-N
Molecular formula
C14H8Cl2N2O
Average molar mass
291.1 g/mol
Monoisotopic mass
290.0013683

Names & identifiers

Preferred name
5-(3-Chlorophenyl)-3-(5-chloropyridin-3-yl)isoxazole
IUPAC
5-(3-chlorophenyl)-3-(5-chloro-3-pyridinyl)-1,2-oxazole

Names & synonyms

SCHEMBL4331569OEFJPRAPEPYOBZ-UHFFFAOYSA-N5-(3-Chlorophenyl)-3-(5-chloropyridin-3-yl)isoxazole

Database identifiers

PubChem CID
44545546

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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