BAY-678

SIGMA/SML1563 - ≥98% (HPLC)

Synonym: 2-Pyridinecarbonitrile, 5-[(4R)-5-acetyl-1,2,3,4-tetrahydro-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-4-pyrimidinyl]-; 5-{(4R)-5-Acetyl-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidin-4-yl}pyridine-2-carbonitrile

CAS Number: 675103-36-3
Empirical Formula (Hill Notation): C₂₀H₁₅F₃N₄O₂
Molecular Weight: 400.35
MDL Number: MFCD29924806
Linear Formula: C₂₀H₁₅F₃N₄O₂
Product Type: Chemical

Catalog Number	PKG Qty.	Price


45-SML1563-5MG	5 mg	$108.00 1/EA	Add To Favorites
45-SML1563-25MG	25 mg	$435.00 1/EA	Add To Favorites

Properties
Descriptions
Safety Info.
Basic Data

assay	≥98% (HPLC)
color	white to light brown
form	powder
InChI	1S/C20H15F3N4O2/c1-11-17(12(2)28)18(13-6-7-15(9-24)25-10-13)26-19(29)27(11)16-5-3-4-14(8-16)20(21,22)23/h3-8,10,18H,1-2H3,(H,26,29)/t18-/m1/s1
InChI key	PGIVGIFOWOVINL-GOSISDBHSA-N
optical activity	[α]/D +21 to +29°, c = 0.5 in methanol
Quality Level	100
SMILES string	CC(N1C2=CC=CC(C(F)(F)F)=C2)=C(C(C)=O)[C@@H](C3=CN=C(C#N)C=C3)NC1=O
solubility	DMSO: 20 mg/mL, clear
storage temp.	2-8°C

Biochem/physiol Actions:	BAY-678 is an orally available, highly potent and selective inhibitor of human neutrophil elastase (HNE). For full characterization details, please visit the BAY-678 probe summary on the Structural Genomics Consortium (SGC) website. BAY-677 is used as a negative control and is available from Sigma. To learn more about and purchase BAY-677, click here . To learn about other SGC chemical probes for protein targets, visit sigma.com/sgc
Features and Benefits:	BAY-678 is a chemical probe available through a partnership with the Structural Genomics Consortium (SGC). To learn more and view other SGC chemical probes, visit sigma.com/SGC .
Packaging:	5, 25 mg in glass bottle

RIDADR	NONH for all modes of transport
WGK Germany	WGK 3
Flash Point(F)	Not applicable
Flash Point(C)	Not applicable

Purity	≥98% (HPLC)
Storage Temp.	2-8°C
UNSPSC	12352200

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