Basic information
- Standard SMILES
COc1ccc(-c2nc(Cn3ccnn3)co2)cc1- InChIKey
CEJFZZVCBONBGT-UHFFFAOYSA-N- Molecular formula
- C13H12N4O2
- Average molar mass
- 256.26 g/mol
Names & identifiers
- Preferred name
- 1-[2-(4-methoxy-phenyl)-oxazol-4-ylmethyl]-1H-[1,2,3]triazole
- IUPAC
- 2-(4-methoxyphenyl)-4-(triazol-1-ylmethyl)-1,3-oxazole
Names & synonyms
SCHEMBL5389906CEJFZZVCBONBGT-UHFFFAOYSA-N1-[2-(4-methoxy-phenyl)-oxazol-4-ylmethyl]-1H-[1,2,3]triazole
Database identifiers
- PubChem CID
- 69424980
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 284
Related reactions
2 records
Compound notes
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