1,3,4-Oxadiazole, 2-(2-methylphenyl)-5-phenyl-
Basic information
- CAS
59663-63-7- Standard SMILES
Cc1ccccc1-c1nnc(-c2ccccc2)o1- InChIKey
ZCRJBSKEADQYHE-UHFFFAOYSA-N- Molecular formula
- C15H12N2O
- Average molar mass
- 236.27 g/mol
- Monoisotopic mass
- 236.09496301
Names & identifiers
- Preferred name
- 1,3,4-Oxadiazole, 2-(2-methylphenyl)-5-phenyl-
- IUPAC
- 2-(2-methylphenyl)-5-phenyl-1,3,4-oxadiazole
Names & synonyms
1,3,4-Oxadiazole, 2-(2-methylphenyl)-5-phenyl-59663-63-7DTXSID80293579RefChem:216909DTXCID902447192-(2-methylphenyl)-5-phenyl-1,3,4-oxadiazoleNSC908092-(o-tolyl)-5-phenyl-1,3,4-oxadiazoleCambridge id 5707810MLS000108051SCHEMBL3429916CHEMBL1299268
Show more names
SCHEMBL32558542HMS1609A02HMS2167J19HMS3317J18MFCD01114451NSC-90809AKOS001603913SMR000104014
Database identifiers
- CAS
59663-63-7- PubChem CID
- 259999
- DTXSID
DTXSID80293579- ChEMBL
CHEMBL1299268- Nikkaji
- J2.767.412G
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 265
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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