7-(4-chlorophenyl)-2-((2-ethyl-6-(trifluoromethyl)pyridin-3-yl)methyl)-8-(pyridin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one

HCID 16005347
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Basic information

Standard SMILES
CCc1nc(C(F)(F)F)ccc1Cn1nc2c(-c3ccncc3)c(-c3ccc(Cl)cc3)ccn2c1=O
InChIKey
UGXBXCXTPQAWHV-UHFFFAOYSA-N
Molecular formula
C26H19ClF3N5O
Average molar mass
509.9 g/mol

Names & identifiers

Preferred name
7-(4-chlorophenyl)-2-((2-ethyl-6-(trifluoromethyl)pyridin-3-yl)methyl)-8-(pyridin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
IUPAC
7-(4-chlorophenyl)-2-[[2-ethyl-6-(trifluoromethyl)-3-pyridinyl]methyl]-8-pyridin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-3-one

Names & synonyms

7-(4-chlorophenyl)-2-((2-ethyl-6-(trifluoromethyl)pyridin-3-yl)methyl)-8-(pyridin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-oneSCHEMBL4488160

Database identifiers

PubChem CID
16005347

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
61.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
36

Related reactions

3 records
New reaction record

Linked notes

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