2-(4-Methoxyphenyl)-5-(3-pyridinyl)-1,3,4-oxadiazole
Basic information
- CAS
56352-93-3- Standard SMILES
COc1ccc(-c2nnc(-c3cccnc3)o2)cc1- InChIKey
WMIQKYZPVJCIPR-UHFFFAOYSA-N- Molecular formula
- C14H11N3O2
- Average molar mass
- 253.26 g/mol
- Monoisotopic mass
- 253.0851266
Overview
2-(4-methoxyphenyl)-5-(3-pyridinyl)-1,3,4-oxadiazole is a member of methoxybenzenes.
Names & identifiers
- Preferred name
- 2-(4-Methoxyphenyl)-5-(3-pyridinyl)-1,3,4-oxadiazole
- IUPAC
- 2-(4-methoxyphenyl)-5-pyridin-3-yl-1,3,4-oxadiazole
Names & synonyms
56352-93-32-(4-methoxyphenyl)-5-(3-pyridinyl)-1,3,4-oxadiazole2-(4-methoxyphenyl)-5-pyridin-3-yl-1,3,4-oxadiazolePyridine, 3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-ST0705273-[5-(4-METHOXYPHENYL)-1,3,4-OXADIAZOL-2-YL]PYRIDINEMLS-0073079.0001Oprea1_129508Oprea1_207441MLS000067760cid_865615SCHEMBL1423243
Show more names
CHEMBL1385182BDBM64805DTXSID40357722CHEBI:1127313-[5-(4-Methoxy-phenyl)-[1,3,4]oxadiazol-2-yl]-pyridineHMS2372N05NSC782224AKOS000730298
Database identifiers
- CAS
56352-93-3- PubChem CID
- 865615
- DTXSID
DTXSID40357722- ChEMBL
CHEMBL1385182- ChEBI
CHEBI:112731- Nikkaji
- J3.542.044D
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 61 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 282
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Related reactions
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Compound notes
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