Basic information
- Standard SMILES
CCS(=O)c1ccccc1-c1nc2cc(C(F)(F)F)cnc2n1C- InChIKey
RHAQOQCNOJLKFW-UHFFFAOYSA-N- Molecular formula
- C16H14F3N3OS
- Average molar mass
- 353.4 g/mol
Names & identifiers
- Preferred name
- 2-(2-ethylsulfinylphenyl)-3-methyl-6-trifluoromethyl-3H-imidazo[4,5-b]pyridine
- IUPAC
- 2-(2-ethylsulfinylphenyl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine
Names & synonyms
2-(2-ethylsulfinylphenyl)-3-methyl-6-trifluoromethyl-3H-imidazo[4,5-b]pyridineSCHEMBL15412786
Database identifiers
- PubChem CID
- 86708192
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 67 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 476
Related reactions
2 records
Compound notes
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