(S)-N-(5-bromo-6-(2-(3,5-difluorophenyl)-1-(1,1-dimethylethylsulfinamido)ethyl)pyridin-2-yl)acetamide

HCID 90280239
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Basic information

Standard SMILES
CC(=O)Nc1ccc(Br)c([C@H](Cc2cc(F)cc(F)c2)NS(=O)C(C)(C)C)n1
InChIKey
CXPHQGXZVNTTIG-WCZHWJSASA-N
Molecular formula
C19H22BrF2N3O2S
Average molar mass
474.4 g/mol

Names & identifiers

Preferred name
(S)-N-(5-bromo-6-(2-(3,5-difluorophenyl)-1-(1,1-dimethylethylsulfinamido)ethyl)pyridin-2-yl)acetamide
IUPAC
N-[5-bromo-6-[(1S)-1-(tert-butylsulfinylamino)-2-(3,5-difluorophenyl)ethyl]-2-pyridinyl]acetamide

Names & synonyms

SCHEMBL15873966CXPHQGXZVNTTIG-WCZHWJSASA-N(S)-N-(5-bromo-6-(2-(3,5-difluorophenyl)-1-(1,1-dimethylethylsulfinamido)ethyl)pyridin-2-yl)acetamide

Database identifiers

PubChem CID
90280239

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
90.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
7
Heavy atoms
28

Related reactions

2 records
New reaction record

Compound notes

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