Basic information
- Standard SMILES
CCOC(=O)COc1ccc(N(Cc2sc(-c3ccc(C(F)(F)F)cc3)nc2C)C(=O)OC(C)(C)C)cc1- InChIKey
QIIUTYBHTHFWLL-UHFFFAOYSA-N- Molecular formula
- C27H29F3N2O5S
- Average molar mass
- 550.6 g/mol
Names & identifiers
- Preferred name
- (4-{Tert-butoxycarbonyl-[4-methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-ylmethyl]-amino}-phenoxy)-acetic acid ethyl ester
- IUPAC
- ethyl 2-[4-[(2-methylpropan-2-yl)oxycarbonyl-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methyl]amino]phenoxy]acetate
Names & synonyms
(4-{tert-butoxycarbonyl-[4-methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-ylmethyl]-amino}-phenoxy)-acetic acid ethyl esterSCHEMBL4854322
Database identifiers
- PubChem CID
- 69218280
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 11
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 778
Related reactions
3 records
Compound notes
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