Basic information
- Standard SMILES
O=S(=O)(Nc1cc(C(F)(F)F)ccc1Oc1ccccc1CO)c1cc(C(F)(F)F)cc(C(F)(F)F)c1- InChIKey
YOPYMDYXBDUKCP-UHFFFAOYSA-N- Molecular formula
- C22H14F9NO4S
- Average molar mass
- 559.4 g/mol
Names & identifiers
- Preferred name
- 2-[2-[3,5-Bis(trifluoromethyl)phenylsulfonamido]-4-trifluoromethylphenoxy]benzyl alcohol
- IUPAC
- N-[2-[2-(hydroxymethyl)phenoxy]-5-(trifluoromethyl)phenyl]-3,5-bis(trifluoromethyl)benzenesulfonamide
Names & synonyms
2-[2-[3,5-Bis(trifluoromethyl)phenylsulfonamido]-4-trifluoromethylphenoxy]benzyl alcoholSCHEMBL8077001
Database identifiers
- PubChem CID
- 54519282
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 84 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 6
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 834
Related reactions
2 records
Compound notes
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