5-(4-Acetylpiperazin-1-yl)-N-((3-methyl-2'-(trifluoromethyl)-2,4'-bipyridin-5-yl)methyl)picolinamide

HCID 56599028
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Basic information

Standard SMILES
CC(=O)N1CCN(c2ccc(C(=O)NCc3cnc(-c4ccnc(C(F)(F)F)c4)c(C)c3)nc2)CC1
InChIKey
JAUQOEGLCGSWMF-UHFFFAOYSA-N
Molecular formula
C25H25F3N6O2
Average molar mass
498.5 g/mol
Monoisotopic mass
498.19910855

Names & identifiers

Preferred name
5-(4-Acetylpiperazin-1-yl)-N-((3-methyl-2'-(trifluoromethyl)-2,4'-bipyridin-5-yl)methyl)picolinamide
IUPAC
5-(4-acetylpiperazin-1-yl)-N-[[5-methyl-6-[2-(trifluoromethyl)-4-pyridinyl]-3-pyridinyl]methyl]pyridine-2-carboxamide

Names & synonyms

5-(4-Acetylpiperazin-1-yl)-N-((3-methyl-2'-(trifluoromethyl)-2,4'-bipyridin-5-yl)methyl)picolinamideSCHEMBL245851

Database identifiers

PubChem CID
56599028

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
91.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
9
Rotatable bonds
5
Heavy atoms
36

Related reactions

1 records
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Compound notes

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