Basic information
- CAS
568577-47-9- Standard SMILES
CN(C)c1ccc(C(O)c2nnc(-c3ccccc3)o2)cc1- InChIKey
BYBZDFVNCDUXQI-UHFFFAOYSA-N- Molecular formula
- C17H17N3O2
- Average molar mass
- 295.34 g/mol
- Monoisotopic mass
- 295.13207679
Names & identifiers
- Preferred name
- [4-(Dimethylamino)phenyl](5-phenyl-1,3,4-oxadiazol-2-yl)methanol
- IUPAC
- [4-(dimethylamino)phenyl]-(5-phenyl-1,3,4-oxadiazol-2-yl)methanol
Names & synonyms
DTXSID301170869HMS1785M13AKOS034466219568577-47-9SR-01000044836SR-01000044836-1Z56928555[4-(dimethylamino)phenyl](5-phenyl-1,3,4-oxadiazol-2-yl)methanolI+/--[4-(Dimethylamino)phenyl]-5-phenyl-1,3,4-oxadiazole-2-methanol
Database identifiers
- CAS
568577-47-9- PubChem CID
- 3554657
- DTXSID
DTXSID301170869
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 62.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 339
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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