Basic information
- CAS
64369-23-9- Standard SMILES
CCc1nn2c(-c3cnns3)nnc2s1- InChIKey
OAFLXJNJVGMXGZ-UHFFFAOYSA-N- Molecular formula
- C7H6N6S2
- Average molar mass
- 238.3 g/mol
- Monoisotopic mass
- 238.00953656
Names & identifiers
- Preferred name
- 6-Ethyl-3-(1,2,3-thiadiazol-5-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
- IUPAC
- 6-ethyl-3-(thiadiazol-5-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Names & synonyms
64369-23-9NSC297291DTXSID60315768NSC-2972916-Ethyl-3-(1,2,3-thiadiazol-5-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Database identifiers
- CAS
64369-23-9- PubChem CID
- 326263
- DTXSID
DTXSID60315768
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 242
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…