Basic information
- Standard SMILES
N#Cc1ccc(C(F)(F)F)cc1NS(N)(=O)=O- InChIKey
REZDPBFJSILLGX-UHFFFAOYSA-N- Molecular formula
- C8H6F3N3O2S
- Average molar mass
- 265.21 g/mol
Names & identifiers
- Preferred name
- N-(2-Cyano-5-trifluoromethylphenyl)sulfamide
- IUPAC
- 1-cyano-2-(sulfamoylamino)-4-(trifluoromethyl)benzene
Names & synonyms
N-(2-Cyano-5-trifluoromethylphenyl)sulfamideSCHEMBL2418119
Database identifiers
- PubChem CID
- 67400577
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 420
Related reactions
2 records
Compound notes
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