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Basic information
- Standard SMILES
Cc1cc(-c2noc(C(F)(F)F)n2)cc(C)c1OCCCc1ccc(CCl)nc1- InChIKey
BTIOVGYQJGTHTG-UHFFFAOYSA-N- Molecular formula
- C20H19ClF3N3O2
- Average molar mass
- 425.8 g/mol
- Monoisotopic mass
- 425.111789
Names & identifiers
- Preferred name
- 6-Chloromethyl-3-[3-[4-(5-trifluoromethyl-1,2,4-oxadiazol-3-yl)-2,6-dimethyl-phenoxy]-propyl]-pyridine
- IUPAC
- 3-[4-[3-[6-(chloromethyl)-3-pyridinyl]propoxy]-3,5-dimethylphenyl]-5-(trifluoromethyl)-1,2,4-oxadiazole
Names & synonyms
6-chloromethyl-3-[3-[4-(5-trifluoromethyl-1,2,4-oxadiazol-3-yl)-2,6-dimethyl-phenoxy]-propyl]-pyridineSCHEMBL8922271
Database identifiers
- PubChem CID
- 19082031
Properties
Computed structural propertiesFilling in
- XLogP
- 5.1
- Topological polar surface area
- 61 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 502
Related reactions
4 records
Compound notes
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