Basic information
- CAS
724430-62-0- Standard SMILES
CCc1nnc2sc(-c3cccc(C(F)(F)F)c3)nn12- InChIKey
HOUROSKOZQFGSC-UHFFFAOYSA-N- Molecular formula
- C12H9F3N4S
- Average molar mass
- 298.29 g/mol
Names & identifiers
- Preferred name
- 3-Ethyl-6-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
- IUPAC
- 3-ethyl-6-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
- English name
- 3-ethyl-6-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
- Molecular formula
- C12H9F3N4S
- Molecular weight
- 298.2868696
Names & synonyms
3-ethyl-6-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole3-ethyl-6-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazoleAP-501/42397575
Database identifiers
- CAS
724430-62-0
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 71.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 354
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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