Basic information
- Standard SMILES
CCOc1cc(Oc2cccc(C(F)(F)F)c2)nc(SC)n1- InChIKey
IKTBHDVLJUXRPF-UHFFFAOYSA-N- Molecular formula
- C14H13F3N2O2S
- Average molar mass
- 330.33 g/mol
Names & identifiers
- Preferred name
- 4-Ethoxy-2-methylthio-6-[3-(trifluoromethyl)phenoxy]pyrimidine
- IUPAC
- 4-ethoxy-2-methylsulfanyl-6-[3-(trifluoromethyl)phenoxy]pyrimidine
Names & synonyms
4-ethoxy-2-methylthio-6-[3-(trifluoromethyl)phenoxy]pyrimidineSCHEMBL8664737
Database identifiers
- PubChem CID
- 19693868
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 69.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 347
Related reactions
1 records
Linked notes
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