Basic information
- Standard SMILES
CCOC(=O)c1cnn(-c2cccc(-c3ccccc3OCc3ccc(/C=C/c4ccc(C(F)(F)F)cc4)cc3)n2)c1C(F)(F)F- InChIKey
ZPNQDYFCAFBWAY-ZHACJKMWSA-N- Molecular formula
- C34H25F6N3O3
- Average molar mass
- 637.6 g/mol
Names & identifiers
- Preferred name
- Ethyl 5-(trifluoromethyl)-1-(6-{2-[(4-{(E)-2-[4-(trifluoromethyl)phenyl]vinyl}benzyl)oxy]phenyl}pyridin-2-yl)-1H-pyrazole-4-carboxylate
- IUPAC
- ethyl 5-(trifluoromethyl)-1-[6-[2-[[4-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]methoxy]phenyl]-2-pyridinyl]pyrazole-4-carboxylate
Names & synonyms
SCHEMBL1781716ZPNQDYFCAFBWAY-ZHACJKMWSA-NEthyl 5-(trifluoromethyl)-1-(6-{2-[(4-{(E)-2-[4-(trifluoromethyl)phenyl]vinyl}benzyl)oxy]phenyl}pyridin-2-yl)-1H-pyrazole-4-carboxylate
Database identifiers
- PubChem CID
- 86633490
Properties
Computed structural properties
- XLogP
- 8.6
- Topological polar surface area
- 66.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 10
- Heavy atoms
- 46
- Formal charge
- 0
- Complexity
- 994
Related reactions
2 records
Compound notes
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