Phenol, 2-(5-(4-(dimethylamino)phenyl)-1,3,4-oxadiazol-2-yl)-
Basic information
- CAS
111997-60-5- Standard SMILES
CN(C)c1ccc(-c2nnc(-c3ccccc3O)o2)cc1- InChIKey
IEAVALFYMJGXMA-UHFFFAOYSA-N- Molecular formula
- C16H15N3O2
- Average molar mass
- 281.31 g/mol
- Monoisotopic mass
- 281.11642673
Names & identifiers
- Preferred name
- Phenol, 2-(5-(4-(dimethylamino)phenyl)-1,3,4-oxadiazol-2-yl)-
- IUPAC
- 2-[5-[4-(dimethylamino)phenyl]-1,3,4-oxadiazol-2-yl]phenol
Names & synonyms
Phenol, 2-(5-(4-(dimethylamino)phenyl)-1,3,4-oxadiazol-2-yl)-111997-60-5RefChem:1094843BRN 55769002-(5-(4-(Dimethylamino)phenyl)-1,3,4-oxadiazol-2-yl)phenol
Database identifiers
- CAS
111997-60-5- PubChem CID
- 3086792
- Nikkaji
- J2.342.470C
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 62.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 331
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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