Basic information
- Standard SMILES
CCOC(=O)COc1ccc(SCc2sc(-c3ccc(OC(F)(F)F)cc3)cc2C)cc1C- InChIKey
HNDNKONYZSXBTG-UHFFFAOYSA-N- Molecular formula
- C24H23F3O4S2
- Average molar mass
- 496.6 g/mol
- Monoisotopic mass
- 496.09898604
Names & identifiers
- Preferred name
- Ethyl{2-methyl-4-[({3-methyl-5-[4-(trifluoromethoxy)phenyl]thien-2-yl}methyl)thio]phenoxy}acetate
- IUPAC
- ethyl 2-[2-methyl-4-[[3-methyl-5-[4-(trifluoromethoxy)phenyl]thiophen-2-yl]methylsulfanyl]phenoxy]acetate
Names & synonyms
ethyl{2-methyl-4-[({3-methyl-5-[4-(trifluoromethoxy)phenyl]thien-2-yl}methyl)thio]phenoxy}acetate
Database identifiers
- PubChem CID
- 21986465
Properties
Computed structural properties
- XLogP
- 7.5
- Topological polar surface area
- 98.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 10
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 613
Related reactions
1 records
Compound notes
Loading…