Basic information
- Standard SMILES
N=c1sc2cc(OC(F)(F)F)cc3c2n1CCS3- InChIKey
FQTIAONYKGIELQ-UHFFFAOYSA-N- Molecular formula
- C10H7F3N2OS2
- Average molar mass
- 292.3 g/mol
Names & identifiers
- Preferred name
- 2-imino-8-trifluoromethoxy-4,5-dihydro-2H-thiazolo[3,4,5-de][1,4]benzothiazine
- IUPAC
- 6-(trifluoromethoxy)-3,9-dithia-1-azatricyclo[6.3.1.04,12]dodeca-4(12),5,7-trien-2-imine
Names & synonyms
2-imino-8-trifluoromethoxy-4,5-dihydro-2H-thiazolo[3,4,5-de][1,4]benzothiazineSCHEMBL67551582-imino-8-trifluoromethoxy-4,5-dihydro -2H-thiazolo[3,4,5-de][1,4]benzothiazine2-imino-8-trifluoromethoxy-4,5-dihydro-2H-thiazolo[3,4,5-de] [1,4]benzothiazine
Database identifiers
- PubChem CID
- 15550366
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 86.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 366
Related reactions
4 records
Compound notes
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