Basic information
- CAS
4926-15-2- Standard SMILES
Cc1ccc2nnc(-c3ccccc3)n2c1- InChIKey
CMCFBHPRFOHUNM-UHFFFAOYSA-N- Molecular formula
- C13H11N3
- Average molar mass
- 209.25 g/mol
- Monoisotopic mass
- 209.09529736
Names & identifiers
- Preferred name
- 6-Methyl-3-phenyl-[1,2,4]triazolo[4,3-a]pyridine
- IUPAC
- 6-methyl-3-phenyl-[1,2,4]triazolo[4,3-a]pyridine
Names & synonyms
6-methyl-3-phenyl-[1,2,4]triazolo[4,3-a]pyridine4926-15-26-methyl-3-phenyl[1,2,4]triazolo[4,3-a]pyridine1,2,4-Triazolo[4,3-a]pyridine,6-methyl-3-phenyl-NSC76007SCHEMBL9844320DTXSID50291502NSC-76007DS-008198
Database identifiers
- CAS
4926-15-2- PubChem CID
- 253283
- DTXSID
DTXSID50291502- Nikkaji
- J2.441.819G
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 237
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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