Basic information
- Standard SMILES
Cc1cc(C(=O)C=Cc2sc(-c3ccc(C(F)(F)F)cc3)nc2C)ccc1OCc1ccccc1- InChIKey
LMXCHXPTQHSBNN-UHFFFAOYSA-N- Molecular formula
- C28H22F3NO2S
- Average molar mass
- 493.5 g/mol
Names & identifiers
- Preferred name
- 1-[4-(Benzyloxy)-3-methylphenyl]-3-{4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}prop-2-en-1-one
- IUPAC
- 1-(3-methyl-4-phenylmethoxyphenyl)-3-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]prop-2-en-1-one
Names & synonyms
SCHEMBL5655997LMXCHXPTQHSBNN-UHFFFAOYSA-N1-[4-(benzyloxy)-3-methylphenyl]-3-{4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}prop-2-en-1-one
Database identifiers
- PubChem CID
- 69522022
Properties
Computed structural properties
- XLogP
- 7.5
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 715
Related reactions
1 records
Compound notes
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