3-(2-Fluorophenyl)-6-methyl-3H-[1,2,3]triazolo[4,5-b]pyridine
Basic information
- CAS
62052-15-7- Standard SMILES
Cc1cnc2c(c1)nnn2-c1ccccc1F- InChIKey
KVRHMEDKFLBTIG-UHFFFAOYSA-N- Molecular formula
- C12H9FN4
- Average molar mass
- 228.22 g/mol
- Monoisotopic mass
- 228.08112447
Names & identifiers
- Preferred name
- 3-(2-Fluorophenyl)-6-methyl-3H-[1,2,3]triazolo[4,5-b]pyridine
- IUPAC
- 3-(2-fluorophenyl)-6-methyltriazolo[4,5-b]pyridine
Names & synonyms
62052-15-73-(2-Fluorophenyl)-6-methyl-3H-[1,2,3]triazolo[4,5-b]pyridineCHEMBL3245692DTXSID50498599
Database identifiers
- CAS
62052-15-7- PubChem CID
- 12445501
- DTXSID
DTXSID50498599- ChEMBL
CHEMBL3245692
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 43.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 275
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Compound notes
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