Basic information
- Standard SMILES
Cc1nc(-c2ccc(F)cc2)n(-c2ccc(S(N)(=O)=O)cn2)n1- InChIKey
CZOJQBPXAASNJW-UHFFFAOYSA-N- Molecular formula
- C14H12FN5O2S
- Average molar mass
- 333.34 g/mol
- Monoisotopic mass
- 333.06957398
Names & identifiers
- Preferred name
- 6-[5-(4-Fluoro-phenyl)-3-methyl-[1,2,4]triazole-1-yl]-pyridine-3-sulfonic acid amide
- IUPAC
- 6-[5-(4-fluorophenyl)-3-methyl-1,2,4-triazol-1-yl]pyridine-3-sulfonamide
Names & synonyms
SCHEMBL5202962CZOJQBPXAASNJW-UHFFFAOYSA-N6-[5-(4-fluoro-phenyl)-3-methyl-[1,2,4]triazole-1-yl]-pyridine-3-sulfonic acid amide
Database identifiers
- PubChem CID
- 10172083
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 506
Related reactions
2 records
Compound notes
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