Basic information
- Standard SMILES
COC(Cc1ccc(OC(C)(C)C(=O)NCCc2cccc(C(F)(F)F)c2)cc1)C(=O)O- InChIKey
INCRKCYQUFEKII-UHFFFAOYSA-N- Molecular formula
- C23H26F3NO5
- Average molar mass
- 453.5 g/mol
Names & identifiers
- Preferred name
- 2-Methoxy-3-(4-{1-methyl-1-[2-(3-trifluoromethyl-phenyl)-ethylcarbamoyl]-ethoxy}-phenyl)-propionic acid
- IUPAC
- 2-methoxy-3-[4-[2-methyl-1-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethylamino]propan-2-yl]oxyphenyl]propanoic acid
Names & synonyms
2-methoxy-3-(4-{1-methyl-1-[2-(3-trifluoromethyl-phenyl)-ethylcarbamoyl]-ethoxy}-phenyl)-propionic acidSCHEMBL5364860
Database identifiers
- PubChem CID
- 69418006
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 84.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 617
Related reactions
1 records
Compound notes
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