6-(2-chlorophenyl)-7-(4-chlorophenyl)-5-methyl-2-((6-(trifluoromethyl)pyridin-3-yl)methyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one

HCID 57799361
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Basic information

Standard SMILES
Cc1c(-c2ccccc2Cl)c(-c2ccc(Cl)cc2)cc2nn(Cc3ccc(C(F)(F)F)nc3)c(=O)n12
InChIKey
RWJKJVWOHBWAER-UHFFFAOYSA-N
Molecular formula
C26H17Cl2F3N4O
Average molar mass
529.3 g/mol
Monoisotopic mass
528.0731511

Names & identifiers

Preferred name
6-(2-chlorophenyl)-7-(4-chlorophenyl)-5-methyl-2-((6-(trifluoromethyl)pyridin-3-yl)methyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
IUPAC
6-(2-chlorophenyl)-7-(4-chlorophenyl)-5-methyl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one

Names & synonyms

6-(2-chlorophenyl)-7-(4-chlorophenyl)-5-methyl-2-((6-(trifluoromethyl)pyridin-3-yl)methyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-oneSCHEMBL4491834

Database identifiers

PubChem CID
57799361

Properties

Computed structural properties

XLogP
5.6
Topological polar surface area
48.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
36

Related reactions

4 records
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Compound notes

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