3-(4-Phenoxyphenyl)-3H-[1,2,3]triazolo[4,5-b]pyridine
Basic information
- CAS
62052-12-4- Standard SMILES
c1ccc(Oc2ccc(-n3nnc4cccnc43)cc2)cc1- InChIKey
PLYHVYHAFVVOJV-UHFFFAOYSA-N- Molecular formula
- C17H12N4O
- Average molar mass
- 288.3 g/mol
- Monoisotopic mass
- 288.10111102
Names & identifiers
- Preferred name
- 3-(4-Phenoxyphenyl)-3H-[1,2,3]triazolo[4,5-b]pyridine
- IUPAC
- 3-(4-phenoxyphenyl)triazolo[4,5-b]pyridine
Names & synonyms
62052-12-43-(4-Phenoxyphenyl)-3H-[1,2,3]triazolo[4,5-b]pyridineCHEMBL3245687DTXSID80498582
Database identifiers
- CAS
62052-12-4- PubChem CID
- 12445477
- DTXSID
DTXSID80498582- ChEMBL
CHEMBL3245687
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 52.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 353
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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