2-[5-(2-Chlorophenyl)-1,2,4-oxadiazol-3-yl]pyridine
Basic information
- CAS
27199-42-4- Standard SMILES
Clc1ccccc1-c1nc(-c2ccccn2)no1- InChIKey
NGKWCJCCZGCLID-UHFFFAOYSA-N- Molecular formula
- C13H8ClN3O
- Average molar mass
- 257.67 g/mol
- Monoisotopic mass
- 257.0355896
Names & identifiers
- Preferred name
- 2-[5-(2-Chlorophenyl)-1,2,4-oxadiazol-3-yl]pyridine
- IUPAC
- 5-(2-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole
Names & synonyms
27199-42-42-[5-(2-chlorophenyl)-1,2,4-oxadiazol-3-yl]pyridinepyridine, 2-[5-(2-chlorophenyl)-1,2,4-oxadiazol-3-yl]-5-(2-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazoleCHEMBL2164554ZINC2382435-(2-Chlorophenyl)-3-(pyridin-2-yl)-1,2,4-oxadiazole3-(2-pyridyl)-5-(2-chlorophenyl)-1,2,4-oxadiazoleZINC00238243CBMicro_041543Clc1ccccc1c1onc(n1)c1ccccn1SCHEMBL4187023
Show more names
DTXSID60354117BDBM50395935EBC-07493MFCD00665265STK097271AKOS0006188028K-371SBIM-0041454.P001
Database identifiers
- CAS
27199-42-4- PubChem CID
- 763879
- DTXSID
DTXSID60354117- ChEMBL
CHEMBL2164554- Nikkaji
- J3.596.764H
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 279
Related reactions
0 records
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Compound notes
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