Ethyl 5-(trifluoromethyl)-1-[6-(2-{[4'-(trifluoromethyl)biphenyl-4-yl]methoxy}phenyl)pyridin-2-yl]-1H-pyrazole-4-carboxylate

HCID 86633489
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)c1cnn(-c2cccc(-c3ccccc3OCc3ccc(-c4ccc(C(F)(F)F)cc4)cc3)n2)c1C(F)(F)F
InChIKey
QDZGOXNDRYXIBZ-UHFFFAOYSA-N
Molecular formula
C32H23F6N3O3
Average molar mass
611.5 g/mol
Monoisotopic mass
611.16436058

Names & identifiers

Preferred name
Ethyl 5-(trifluoromethyl)-1-[6-(2-{[4'-(trifluoromethyl)biphenyl-4-yl]methoxy}phenyl)pyridin-2-yl]-1H-pyrazole-4-carboxylate
IUPAC
ethyl 5-(trifluoromethyl)-1-[6-[2-[[4-[4-(trifluoromethyl)phenyl]phenyl]methoxy]phenyl]-2-pyridinyl]pyrazole-4-carboxylate

Names & synonyms

Ethyl 5-(trifluoromethyl)-1-[6-(2-{[4'-(trifluoromethyl)biphenyl-4-yl]methoxy}phenyl)pyridin-2-yl]-1H-pyrazole-4-carboxylateSCHEMBL1780667

Database identifiers

PubChem CID
86633489

Properties

Computed structural properties

XLogP
7.9
Topological polar surface area
66.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
11
Rotatable bonds
9
Heavy atoms
44

Related reactions

3 records
New reaction record

Compound notes

Loading…