Basic information
- CAS
66517-21-3- Standard SMILES
O=[N+]([O-])c1ccc(-c2nc3sccn3c2Br)cc1- InChIKey
UVFSOWAQHYTTPY-UHFFFAOYSA-N- Molecular formula
- C11H6BrN3O2S
- Average molar mass
- 324.16 g/mol
- Monoisotopic mass
- 322.93641
Names & identifiers
- Preferred name
- 5-Bromo-6-{4-nitrophenyl}imidazo[2,1-b][1,3]thiazole
- IUPAC
- 5-bromo-6-(4-nitrophenyl)imidazo[2,1-b][1,3]thiazole
- English name
- 5-bromo-6-{4-nitrophenyl}imidazo[2,1-b][1,3]thiazole
- Molecular formula
- C11H6BrN3O2S
- Molecular weight
- 324.15324
Names & synonyms
5-bromo-6-{4-nitrophenyl}imidazo[2,1-b][1,3]thiazole5-bromo-6-(4-nitrophenyl)imidazo[2,1-b][1,3]thiazoleAKOS005145129AB-601/30965053
Database identifiers
- CAS
66517-21-3- PubChem CID
- 824453
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 91.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 333
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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