ChemicalBook > CAS DataBase List > BAY-598(S-isomer)

BAY-598(S-isomer)

Product Name: BAY-598(S-isomer)
CAS No.: 1906919-67-2
Chemical Name: BAY-598(S-isomer)
Synonyms: CS-2678;CPD1616;BAY-598;(S)-BAY-598;BAY-598 (BAY598;BAY-598(S-isomer);BAY-598, 10 mM in DMSO;BAY-598,Inhibitor,BAY598,inhibit,Histone Methyltransferase,BAY 598;(S)-N-(1-(N-Cyano-N'-(3-(difluoromethoxy)phenyl)carbamimidoyl)-3-(3,4-dichlorophenyl)-4,5-dihydro-1H-pyrazol-4-yl)-N-ethyl-2-hydroxyacetamide;N-[(4S)-1-[(Cyanoamino)[[3-(difluoromethoxy)phenyl]imino]methyl]-3-(3,4-dichlorophenyl)-4,5-dihydro-1H-pyrazol-4-yl]-N-ethyl-2-hydroxyacetamide
CBNumber: CB73364108
Molecular Formula: C22H20Cl2F2N6O3
Formula Weight: 525.34
MOL File: 1906919-67-2.mol

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BAY-598(S-isomer) Property

Boiling point:: 663.5±65.0 °C(Predicted)
Density: 1.46±0.1 g/cm3(Predicted)
storage temp.: 2-8°C
solubility: DMSO:69.18(Max Conc. mg/mL);131.69(Max Conc. mM)
DMF:30.0(Max Conc. mg/mL);57.11(Max Conc. mM)
Ethanol:30.0(Max Conc. mg/mL);57.11(Max Conc. mM)
form: powder
pka: 13.34±0.10(Predicted)
color: white to beige
optical activity: [α]/D -85 to -95°, c = 1 in methanol

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word: Warning
Hazard statements: H302Harmful if swallowed

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N-Bromosuccinimide Price

Sigma-Aldrich

Product number: SML1603
Product name: BAY-598
Purity: ≥98% (HPLC)
Packaging: 5MG
Price: $276.92
Updated: 2025/07/31

Sigma-Aldrich

Product number: SML1603
Product name: BAY-598
Purity: ≥98% (HPLC)
Packaging: 25MG
Price: $953
Updated: 2025/07/31

Cayman Chemical

Product number: 18238
Product name: BAY 598
Purity: ≥98%
Packaging: 500μg
Price: $37
Updated: 2024/03/01

Cayman Chemical

Product number: 18238
Product name: BAY 598
Purity: ≥98%
Packaging: 1mg
Price: $65
Updated: 2024/03/01

Cayman Chemical

Product number: 18238
Product name: BAY 598
Purity: ≥98%
Packaging: 5mg
Price: $266
Updated: 2024/03/01

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BAY-598(S-isomer) Chemical Properties,Usage,Production

Uses

BAY-598 is an aminopyrazoline-based novel substrate-competitive inhibitor of protein lysine methyltransferase SMYD2 that serves as potent and selective in vivo probe for SMYD2.

Biochem/physiol Actions

BAY-598 is a potent, peptide-competitive chemical probe for SET and MYND domain-containing protein 2 (SMYD2), a lysine methyl transferase inhibitor that dimethylates histone H3K36 and methylates histone H3K4. SMYD2 also methylates Lys-370 of p53, leading to decreased DNA-binding activity. SMYD2 is over-expressed in several cancers with poor prognosis. BAY-598 inhibits in vitro methylation of p53K370 with an IC50 value of 27 nM and in cells with an IC50 value < 1 μM. BAY-598 is more than 100-fold selective over other histone methyltransferases and non-epigenetic targets. BAY-598 can be used with in vivo experiments. For full characterization details, please visit the BAY-598 probe summary on the Structural Genomics Consortium (SGC) website.BAY-369 is the negative control for the active probe, BAY-598. To request a sample of the negative control from the SGC, click here.To learn about other SGC chemical probes for epigenetic targets, visit sigma.com/sgc

IC 50

SMYD2

storage

Store at -20°C

BAY-598(S-isomer) Preparation Products And Raw materials

Raw materials

Preparation Products

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1906919-67-2, BAY-598(S-isomer)Related Search:

BAY-598

CPD1616

CS-2678

N-[(4S)-1-[(Cyanoamino)[[3-(difluoromethoxy)phenyl]imino]methyl]-3-(3,4-dichlorophenyl)-4,5-dihydro-1H-pyrazol-4-yl]-N-ethyl-2-hydroxyacetamide

BAY-598 (BAY598

(S)-BAY-598

(S,E)-N-(1-(N'-cyano-N-(3-(difluoromethoxy)phenyl)carbamimidoyl)-3-(3,4-dichlorophenyl)-4,5-dihydro-1H-pyrazol-4-yl)-N-ethyl-2-hydroxyacetamide

Acetamide, N-[(4S)-1-[(cyanoamino)[[3-(difluoromethoxy)phenyl]imino]methyl]-3-(3,4-dichlorophenyl)-4,5-dihydro-1H-pyrazol-4-yl]-N-ethyl-2-hydroxy-

BAY-598(S-isomer)

BAY-598,Inhibitor,BAY598,inhibit,Histone Methyltransferase,BAY 598

(S)-N-(1-(N-Cyano-N'-(3-(difluoromethoxy)phenyl)carbamimidoyl)-3-(3,4-dichlorophenyl)-4,5-dihydro-1H-pyrazol-4-yl)-N-ethyl-2-hydroxyacetamide

BAY-598, 10 mM in DMSO

1906919-67-2

906919-67-2

C22H20Cl2F2N6O3