6-(1-(2-fluorobenzyl)-5-(thiazol-2-yl)-1H-1,2,4-triazol-3-yl)pyridin-2-amine
Basic information
- Standard SMILES
Nc1cccc(-c2nc(-c3nccs3)n(Cc3ccccc3F)n2)n1- InChIKey
CECHVPUDFIOXLF-UHFFFAOYSA-N- Molecular formula
- C17H13FN6S
- Average molar mass
- 352.4 g/mol
Names & identifiers
- Preferred name
- 6-(1-(2-fluorobenzyl)-5-(thiazol-2-yl)-1H-1,2,4-triazol-3-yl)pyridin-2-amine
- IUPAC
- 6-[1-[(2-fluorophenyl)methyl]-5-(1,3-thiazol-2-yl)-1,2,4-triazol-3-yl]pyridin-2-amine
Names & synonyms
SCHEMBL4562589CECHVPUDFIOXLF-UHFFFAOYSA-N6-(1-(2-fluorobenzyl)-5-(thiazol-2-yl)-1H-1,2,4-triazol-3-yl)pyridin-2-amine
Database identifiers
- PubChem CID
- 69094239
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 443
Related reactions
2 records
Compound notes
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