Basic information
- Standard SMILES
Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1CCOc1ccc2ccn(CC(=O)OC(C)(C)C)c2c1- InChIKey
IOTOQXQTIMJPKG-UHFFFAOYSA-N- Molecular formula
- C27H27F3N2O3S
- Average molar mass
- 516.6 g/mol
Names & identifiers
- Preferred name
- (6-{2-[4-Methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-yl]-ethoxy}-indol-1-yl)-acetic acid tert-butyl ester
- IUPAC
- tert-butyl 2-[6-[2-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]ethoxy]indol-1-yl]acetate
Names & synonyms
(6-{2-[4-methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-yl]-ethoxy}-indol-1-yl)-acetic acid tert-butyl esterSCHEMBL5017439
Database identifiers
- PubChem CID
- 69280492
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 81.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 9
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 739
Related reactions
4 records
Compound notes
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