Basic information
- Standard SMILES
COC(=O)c1ccc(OCc2sc(-c3ccc(C(F)(F)F)cc3)nc2C)cc1- InChIKey
VHSUBAPWBZNAMA-UHFFFAOYSA-N- Molecular formula
- C20H16F3NO3S
- Average molar mass
- 407.4 g/mol
- Monoisotopic mass
- 407.08029903
Names & identifiers
- Preferred name
- 4-[4-Methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-ylmethoxy]-benzoic acid methyl ester
- IUPAC
- methyl 4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methoxy]benzoate
Names & synonyms
4-[4-Methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-ylmethoxy]-benzoic acid methyl esterSCHEMBL1553892
Database identifiers
- PubChem CID
- 57804307
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 517
Related reactions
4 records
Compound notes
Loading…