Basic information
- Standard SMILES
CC(C)c1nc(-c2ccc(C(F)(F)F)cc2)sc1CNc1ccc([C@@H]2C[C@H]2C(=O)O)cc1- InChIKey
BBJQRQHJHVSUBN-RBUKOAKNSA-N- Molecular formula
- C24H23F3N2O2S
- Average molar mass
- 460.5 g/mol
Names & identifiers
- Preferred name
- Racemic-(trans)-2-{4-[({4-isopropyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}methyl)amino]phenyl}cyclopropanecarboxylic acid
- IUPAC
- trans-(1R,2R)-2-[4-[[4-propan-2-yl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylamino]phenyl]cyclopropane-1-carboxylic acid
Names & synonyms
racemic-(trans)-2-{4-[({4-isopropyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}methyl)amino]phenyl}cyclopropanecarboxylic acidSCHEMBL3741796
Database identifiers
- PubChem CID
- 11202011
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 90.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 646
Related reactions
2 records
Compound notes
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