Basic information
- Standard SMILES
CC(C)Cc1ccc(-c2nc(-c3ccc(C(C)O)cc3)no2)cc1- InChIKey
ZBCLIIYQZLQOAR-UHFFFAOYSA-N- Molecular formula
- C20H22N2O2
- Average molar mass
- 322.4 g/mol
Names & identifiers
- Preferred name
- (+/-)-4-(5-(4-(2-Methylpropyl)phenyl)-1,2,4-oxadiazol-3-yl)-1-(1-hydroxyethyl)benzene
- IUPAC
- 1-[4-[5-[4-(2-methylpropyl)phenyl]-1,2,4-oxadiazol-3-yl]phenyl]ethanol
Names & synonyms
SCHEMBL4742811ZBCLIIYQZLQOAR-UHFFFAOYSA-N(+/-)-4-(5-(4-(2-Methylpropyl)phenyl)-1,2,4-oxadiazol-3-yl)-1-(1-hydroxyethyl)benzene
Database identifiers
- PubChem CID
- 18446989
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 59.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 374
Related reactions
2 records
Compound notes
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