3-(Thiadiazol-5-yl)-6-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Basic information
- CAS
64369-24-0- Standard SMILES
FC(F)(F)c1nn2c(-c3cnns3)nnc2s1- InChIKey
GEPYMYMBSCJQKY-UHFFFAOYSA-N- Molecular formula
- C6HF3N6S2
- Average molar mass
- 278.2 g/mol
- Monoisotopic mass
- 277.96562089
Names & identifiers
- Preferred name
- 3-(Thiadiazol-5-yl)-6-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
- IUPAC
- 3-(thiadiazol-5-yl)-6-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Names & synonyms
64369-24-0NSC2968643-(thiadiazol-5-yl)-6-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazoleDTXSID30315730NSC-2968643-(1,2,3-Thiadiazol-5-yl)-6-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Database identifiers
- CAS
64369-24-0- PubChem CID
- 326192
- DTXSID
DTXSID30315730
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 304
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…