Basic information
- Standard SMILES
CCc1cc(SCc2cc(-c3ccc(C(F)(F)F)cc3)oc2C)ccc1OCC(=O)O- InChIKey
SFNNLGOPNQUXCV-UHFFFAOYSA-N- Molecular formula
- C23H21F3O4S
- Average molar mass
- 450.5 g/mol
Names & identifiers
- Preferred name
- {2-Ethyl-4-[({2-methyl-5-[4-(trifluoromethyl)phenyl]-3-furyl}methyl)thio]phenoxy}acetic acid
- IUPAC
- 2-[2-ethyl-4-[[2-methyl-5-[4-(trifluoromethyl)phenyl]furan-3-yl]methylsulfanyl]phenoxy]acetic acid
Names & synonyms
{2-ethyl-4-[({2-methyl-5-[4-(trifluoromethyl)phenyl]-3-furyl}methyl)thio]phenoxy}acetic acidSCHEMBL5861766
Database identifiers
- PubChem CID
- 10225846
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 85 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 580
Related reactions
4 records
Compound notes
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