Basic information
- Standard SMILES
Cc1oc(-c2cccs2)nc1CCOc1ccc(CC(C)(Oc2ccc(Cl)cc2)C(=O)O)cc1- InChIKey
STWCVDCCKILUMT-UHFFFAOYSA-N- Molecular formula
- C26H24ClNO5S
- Average molar mass
- 498 g/mol
Names & identifiers
- Preferred name
- 2-(4-Chlorophenoxy)-2-methyl-3-{4-[2-(5-methyl-2-thiophen-2-yl-oxazol-4-yl)-ethoxy]-phenyl}-propionic Acid
- IUPAC
- 2-(4-chlorophenoxy)-2-methyl-3-[4-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethoxy]phenyl]propanoic acid
Names & synonyms
SCHEMBL5108716STWCVDCCKILUMT-UHFFFAOYSA-N2-(4-Chlorophenoxy)-2-methyl-3-{4-[2-(5-methyl-2-thiophen-2-yl-oxazol-4-yl)-ethoxy]-phenyl}-propionic Acid
Database identifiers
- PubChem CID
- 22339997
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 10
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 655
Related reactions
2 records
Compound notes
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