Basic information
- Standard SMILES
CCOC(=O)C(Cc1cc(OCC)c(OCCc2nc(-c3ccc(Cl)cc3)sc2C)cc1F)OCC- InChIKey
OMBGZNPIUUPOIN-UHFFFAOYSA-N- Molecular formula
- C27H31ClFNO5S
- Average molar mass
- 536.1 g/mol
Names & identifiers
- Preferred name
- [Rac]-3-(4-{2-[2-(4-chloro-phenyl)-5-methyl-thiazol-4-yl]-ethoxy}-5-ethoxy-2-fluoro-phenyl)-2-ethoxy-propionic acid ethyl ester
- IUPAC
- ethyl 3-[4-[2-[2-(4-chlorophenyl)-5-methyl-1,3-thiazol-4-yl]ethoxy]-5-ethoxy-2-fluorophenyl]-2-ethoxypropanoate
Names & synonyms
SCHEMBL3372841OMBGZNPIUUPOIN-UHFFFAOYSA-N[rac]-3-(4-{2-[2-(4-chloro-phenyl)-5-methyl-thiazol-4-yl]-ethoxy}-5-ethoxy-2-fluoro-phenyl)-2-ethoxy-propionic acid ethyl ester
Database identifiers
- PubChem CID
- 68617320
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 95.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 14
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 656
Related reactions
1 records
Compound notes
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