Basic information
- Standard SMILES
COC(=O)c1nnn2ccc(-c3ccccc3)cc12- InChIKey
BRKAQYSIWDXKJW-UHFFFAOYSA-N- Molecular formula
- C14H11N3O2
- Average molar mass
- 253.26 g/mol
- Monoisotopic mass
- 253.0851266
Names & identifiers
- Preferred name
- Methyl 5-phenyl-[1,2,3]triazolo[1,5-a]pyridine-3-carboxylate
- IUPAC
- methyl 5-phenyltriazolo[1,5-a]pyridine-3-carboxylate
Names & synonyms
1002308-77-1methyl 5-phenyl-[1,2,3]triazolo[1,5-a]pyridine-3-carboxylateSCHEMBL2696406BRKAQYSIWDXKJW-UHFFFAOYSA-NDA-48446
Database identifiers
- PubChem CID
- 67502437
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 56.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 331
Related reactions
4 records
Compound notes
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