Basic information
- CAS
69001-91-8- Standard SMILES
[O-]c1csc2cnc3ccccc3[n+]12- InChIKey
UEQBEOAJMLCGEG-UHFFFAOYSA-N- Molecular formula
- C10H6N2OS
- Average molar mass
- 202.23 g/mol
- Monoisotopic mass
- 202.02008399
Names & identifiers
- Preferred name
- Thiazolo[3,2-a]quinoxalin-10-ium, 1-hydroxy-, inner salt
- IUPAC
- [1,3]thiazolo[3,2-a]quinoxalin-10-ium-1-olate
Names & synonyms
DTXSID001199557Thiazolo[3,2-a]quinoxalin-10-ium, 1-hydroxy-, inner salt69001-91-8[1,3]Thiazolo[3,2-a]quinoxalin-10-ium-1-olate
Database identifiers
- CAS
69001-91-8- PubChem CID
- 12468554
- DTXSID
DTXSID001199557
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 68.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 226
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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