Basic information
- CAS
55316-55-7- Standard SMILES
c1ccc2c(c1)nc1snc(-n3ccnc3)n12- InChIKey
GGHJFVINKVHWPZ-UHFFFAOYSA-N- Molecular formula
- C11H7N5S
- Average molar mass
- 241.27 g/mol
- Monoisotopic mass
- 241.04221642
Names & identifiers
- Preferred name
- 1-Imidazol-1-yl-[1,2,4]thiadiazolo[4,5-a]benzimidazole
- IUPAC
- 1-imidazol-1-yl-[1,2,4]thiadiazolo[4,5-a]benzimidazole
Names & synonyms
NSC30150855316-55-7DTXSID50316284NSC-3015083-(imidazol-1-yl)-1,2,4-thiadi-azolo[4,5-a]benzimidazole3-(1H-Imidazol-1-yl)[1,2,4]thiadiazolo[4,5-a][1,3]benzimidazole
Database identifiers
- CAS
55316-55-7- PubChem CID
- 327261
- DTXSID
DTXSID50316284
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 76.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 302
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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