Basic information
- Standard SMILES
Cc1cccc(COC2CCCC(OCc3nc(-c4cccc(C(F)(F)F)c4)oc3C)C2)c1C(=O)O- InChIKey
YWUZBOIKGWCRGK-UHFFFAOYSA-N- Molecular formula
- C27H28F3NO5
- Average molar mass
- 503.5 g/mol
Names & identifiers
- Preferred name
- 2-{3-[2-(3-Trifluoromethylphenyl)-5-methyloxazol-4-ylmethoxy]cyclohexyloxymethyl}-6-methylbenzoic Acid
- IUPAC
- 2-methyl-6-[[3-[[5-methyl-2-[3-(trifluoromethyl)phenyl]-1,3-oxazol-4-yl]methoxy]cyclohexyl]oxymethyl]benzoic acid
Names & synonyms
2-{3-[2-(3-Trifluoromethylphenyl)-5-methyloxazol-4-ylmethoxy]cyclohexyloxymethyl}-6-methylbenzoic AcidSCHEMBL48320322-{3-[2-(3-Trifluoromethylphenyl)-5-methyloxazol4-ylmethoxy]cyclohexyloxymethyl}-6-methylbenzoic Acid
Database identifiers
- PubChem CID
- 22493685
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 81.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 722
Related reactions
3 records
Compound notes
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