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N-{5-[3-(2-Chloro-4-pyrimidinyl)pyrazolo[1,5-a]pyridin-2-yl]-2-methylphenyl}-2,2,2-trifluoroacetamide

HCID 57737231
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1ccc(-c2nn3ccccc3c2-c2ccnc(Cl)n2)cc1NC(=O)C(F)(F)F
InChIKey
FLKMSVHQCKVBML-UHFFFAOYSA-N
Molecular formula
C20H13ClF3N5O
Average molar mass
431.8 g/mol

Names & identifiers

Preferred name
N-{5-[3-(2-Chloro-4-pyrimidinyl)pyrazolo[1,5-a]pyridin-2-yl]-2-methylphenyl}-2,2,2-trifluoroacetamide
IUPAC
N-[5-[3-(2-chloropyrimidin-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-methylphenyl]-2,2,2-trifluoroacetamide

Names & synonyms

N-{5-[3-(2-Chloro-4-pyrimidinyl)pyrazolo[1,5-a]pyridin-2-yl]-2-methylphenyl}-2,2,2-trifluoroacetamideSCHEMBL3540125

Database identifiers

PubChem CID
57737231

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
72.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
3
Heavy atoms
30
Formal charge
0
Complexity
624

Related reactions

1 records
New reaction record
HRID 1157632 reaction equation
HRID 1157632As productuspto-grants-2010_10

Compound notes

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