1,3,4-Oxadiazole, 2-(2-furanyl)-5-[4-(5-phenyl-2-oxazolyl)phenyl]-
Basic information
- CAS
127612-17-3- Standard SMILES
c1ccc(-c2cnc(-c3ccc(-c4nnc(-c5ccco5)o4)cc3)o2)cc1- InChIKey
WJLCIDBXNFIRQP-UHFFFAOYSA-N- Molecular formula
- C21H13N3O3
- Average molar mass
- 355.3 g/mol
- Monoisotopic mass
- 355.09569129
Names & identifiers
- Preferred name
- 1,3,4-Oxadiazole, 2-(2-furanyl)-5-[4-(5-phenyl-2-oxazolyl)phenyl]-
- IUPAC
- 2-(furan-2-yl)-5-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]-1,3,4-oxadiazole
Names & synonyms
127612-17-31,3,4-Oxadiazole, 2-(2-furanyl)-5-[4-(5-phenyl-2-oxazolyl)phenyl]-2-(furan-2-yl)-5-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]-1,3,4-oxadiazoleDTXSID30398028
Database identifiers
- CAS
127612-17-3- PubChem CID
- 3929989
- DTXSID
DTXSID30398028
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 78.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 479
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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