5-Nitro-6-(nitrophenyl)imidazo(2,1-b)thiazole
Basic information
- CAS
96126-06-6- Standard SMILES
O=[N+]([O-])c1ccccc1-c1nc2sccn2c1[N+](=O)[O-]- InChIKey
VKUDKRKFKJFDPD-UHFFFAOYSA-N- Molecular formula
- C11H6N4O4S
- Average molar mass
- 290.26 g/mol
- Monoisotopic mass
- 290.01097586
Names & identifiers
- Preferred name
- 5-Nitro-6-(nitrophenyl)imidazo(2,1-b)thiazole
- IUPAC
- 5-nitro-6-(2-nitrophenyl)imidazo[2,1-b][1,3]thiazole
Names & synonyms
96126-06-6Imidazo(2,1-b)thiazole, 5-nitro-6-(nitrophenyl)-5-Nitro-6-(nitrophenyl)imidazo(2,1-b)thiazole5-nitro-6-(2-nitrophenyl)imidazo[2,1-b][1,3]thiazoleDTXSID30242138
Database identifiers
- CAS
96126-06-6- PubChem CID
- 150402
- DTXSID
DTXSID30242138
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 137 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 412
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Compound notes
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