Basic information
- CAS
62051-92-7- Standard SMILES
Cc1ccc(F)c(-n2nnc3cccnc32)c1- InChIKey
NFZIPRWIUURKRM-UHFFFAOYSA-N- Molecular formula
- C12H9FN4
- Average molar mass
- 228.22 g/mol
- Monoisotopic mass
- 228.08112447
Names & identifiers
- Preferred name
- 3-(2-Fluoro-5-methylphenyl)-3H-[1,2,3]triazolo[4,5-b]pyridine
- IUPAC
- 3-(2-fluoro-5-methylphenyl)triazolo[4,5-b]pyridine
Names & synonyms
62051-92-73-(2-Fluoro-5-methylphenyl)-3H-[1,2,3]triazolo[4,5-b]pyridineCHEMBL3245671DTXSID20498566
Database identifiers
- CAS
62051-92-7- PubChem CID
- 12445461
- DTXSID
DTXSID20498566- ChEMBL
CHEMBL3245671
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
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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