10H-Pyrido[3,2-b][1,4]benzothiazine, 8-(trifluoromethyl)-, hydrochloride (1:1)
Basic information
- CAS
158438-82-5- Standard SMILES
Cl.FC(F)(F)c1ccc2c(c1)Nc1ncccc1S2- InChIKey
VKGGAVPQNSVIDH-UHFFFAOYSA-N- Molecular formula
- C12H8ClF3N2S
- Average molar mass
- 304.72 g/mol
- Monoisotopic mass
- 304.0048816
Names & identifiers
- Preferred name
- 10H-Pyrido[3,2-b][1,4]benzothiazine, 8-(trifluoromethyl)-, hydrochloride (1:1)
- IUPAC
- 8-(trifluoromethyl)-10H-pyrido[3,2-b][1,4]benzothiazine;hydrochloride
Names & synonyms
SCHEMBL8957250DTXSID60137798110H-Pyrido[3,2-b][1,4]benzothiazine, 8-(trifluoromethyl)-, hydrochloride (1:1)158438-82-5
Database identifiers
- CAS
158438-82-5- PubChem CID
- 67737005
- DTXSID
DTXSID601377981
Properties
Computed structural properties
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 310
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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