Basic information
- Standard SMILES
CCOC(=O)C(Cc1ccc(OCCc2nc(-c3ccc(C(C)C)cc3)sc2C)c(C)c1)OCC- InChIKey
OPQBJXFIJURPEZ-UHFFFAOYSA-N- Molecular formula
- C29H37NO4S
- Average molar mass
- 495.7 g/mol
Names & identifiers
- Preferred name
- [Rac]-2-ethoxy-3-(4-{2-[2-(4-isopropyl-phenyl)-5-methyl-thiazol-4-yl]-ethoxy}-3-methyl-phenyl)-propionic acid ethyl ester
- IUPAC
- ethyl 2-ethoxy-3-[3-methyl-4-[2-[5-methyl-2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethoxy]phenyl]propanoate
Names & synonyms
SCHEMBL3374173OPQBJXFIJURPEZ-UHFFFAOYSA-N[rac]-2-ethoxy-3-(4-{2-[2-(4-isopropyl-phenyl)-5-methyl-thiazol-4-yl]-ethoxy}-3-methyl-phenyl)-propionic acid ethyl ester
Database identifiers
- PubChem CID
- 68617869
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 85.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 624
Related reactions
1 records
Compound notes
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