5-Chloro-4-(4-fluoro-benzyl)-pyridine-2-carboxylic acid ((S)-2,2,2-trifluoro-1-pyridin-3-yl-ethyl)-amide

HCID 76282970
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Basic information

Standard SMILES
O=C(N[C@@H](c1cccnc1)C(F)(F)F)c1cc(Cc2ccc(F)cc2)c(Cl)cn1
InChIKey
NPTFKCLVDGOWEX-SFHVURJKSA-N
Molecular formula
C20H14ClF4N3O
Average molar mass
423.8 g/mol

Names & identifiers

Preferred name
5-Chloro-4-(4-fluoro-benzyl)-pyridine-2-carboxylic acid ((S)-2,2,2-trifluoro-1-pyridin-3-yl-ethyl)-amide
IUPAC
5-chloro-4-[(4-fluorophenyl)methyl]-N-[(1S)-2,2,2-trifluoro-1-pyridin-3-ylethyl]pyridine-2-carboxamide

Names & synonyms

5-Chloro-4-(4-fluoro-benzyl)-pyridine-2-carboxylic acid ((S)-2,2,2-trifluoro-1-pyridin-3-yl-ethyl)-amideCHEMBL3908763SCHEMBL15790172BDBM240326US9409866, 41

Database identifiers

PubChem CID
76282970
ChEMBL
CHEMBL3908763

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
54.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
29

Related reactions

1 records
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Compound notes

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