2-(3,4-Diethoxyphenyl)-5-(pyridin-4-yl)-1,3,4-oxadiazole

HCID 856470
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Basic information

Standard SMILES
CCOc1ccc(-c2nnc(-c3ccncc3)o2)cc1OCC
InChIKey
UCIDXHXWKSCMMA-UHFFFAOYSA-N
Molecular formula
C17H17N3O3
Average molar mass
311.33 g/mol

Names & identifiers

Preferred name
2-(3,4-Diethoxyphenyl)-5-(pyridin-4-yl)-1,3,4-oxadiazole
IUPAC
2-(3,4-diethoxyphenyl)-5-pyridin-4-yl-1,3,4-oxadiazole

Names & synonyms

Oprea1_433451Oprea1_851744MLS000687414SCHEMBL1413284CHEMBL1387266UCIDXHXWKSCMMA-UHFFFAOYSA-NBDBM427273HMS2621F09US10544136, Compound 89US10544136, Compound 266AKOS000730393SMR000284945
Show more names
SR-01000338490SR-01000338490-12-(3,4-diethoxyphenyl)-5-(pyridin-4-yl)-1,3,4-oxadiazole

Database identifiers

PubChem CID
856470
ChEMBL
CHEMBL1387266

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
70.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
23

Related reactions

10 records
New reaction record

Linked notes

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