2-Phenyl-5-[4-(2-phenylethenyl)phenyl]-1,3,4-oxadiazole
Basic information
- CAS
16157-14-5- Standard SMILES
C(=Cc1ccc(-c2nnc(-c3ccccc3)o2)cc1)c1ccccc1- InChIKey
DICBXGSBLSHPSR-UHFFFAOYSA-N- Molecular formula
- C22H16N2O
- Average molar mass
- 324.4 g/mol
- Monoisotopic mass
- 324.12626314
Names & identifiers
- Preferred name
- 2-Phenyl-5-[4-(2-phenylethenyl)phenyl]-1,3,4-oxadiazole
- IUPAC
- 2-phenyl-5-[4-(2-phenylethenyl)phenyl]-1,3,4-oxadiazole
Names & synonyms
16157-14-52-phenyl-5-[4-(2-phenylethenyl)phenyl]-1,3,4-oxadiazoleOprea1_077059SCHEMBL14881653DTXSID403981702-Phenyl-5-[4-(2-phenylethen-1-yl)phenyl]-1,3,4-oxadiazole
Database identifiers
- CAS
16157-14-5- PubChem CID
- 3948519
- DTXSID
DTXSID40398170
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 418
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…