BAY-598 R-isomer

• 常用名: BAY-598 R-isomer
• 英文名: BAY-598 R-isomer
• CAS号: 1906920-28-2
• 分子量: 525.335
• 密度: 1.5±0.1 g/cm3
• 沸点: 651.3±65.0 °C at 760 mmHg
• 分子式: C₂₂H₂₀Cl₂F₂N₆O₃
• 熔点: N/A
• 闪点: 347.7±34.3 °C

BAY-598 R-isomer用途

BAY-598 R-isomer is the R-isomer of BAY589. BAY-598 R-isomer may be used as a reference compound. BAY-598 is a potent, peptide-competitive chemical probe for SMYD2. BAY-598 has a unique chemotype relative to the current SMYD2 chemical probe LLY-507. BAY-598 inhibits in vitro methylation of p53K370 with IC50 = 27 nM and has more than 100-fold selectivity over other histone methyltransferases and other non-epigenetic targets. BAY-598 inhibits the methylation of p53K370 in cells with IC50 < 1 μM. (Further to this, BAY-598 has properties that are compatible with in vivo experiments.) A control compound, BAY-369, has also been developed. BAY-369 inhibits the in vitro methylation of p53K370 with IC50 > 70 micromolar.

BAY-598 R-isomer名称

• 英文名: (R)-BAY-598

BAY-598 R-isomer物理化学性质

• 密度: 1.5±0.1 g/cm3
• 沸点: 651.3±65.0 °C at 760 mmHg
• 分子式: C₂₂H₂₀Cl₂F₂N₆O₃
• 分子量: 525.335
• 闪点: 347.7±34.3 °C
• 精确质量: 524.094177
• LogP: 2.43
• 蒸汽压: 0.0±2.1 mmHg at 25°C
• 折射率: 1.629

BAY-598 R-isomer英文别名

• Acetamide, N-[(4R)-1-[(Z)-(cyanoimino)[[3-(difluoromethoxy)phenyl]amino]methyl]-3-(3,4-dichlorophenyl)-4,5-dihydro-1H-pyrazol-4-yl]-N-ethyl-2-hydroxy-
• N-[(4R)-1-{N'-Cyano-N-[3-(difluoromethoxy)phenyl]carbamimidoyl}-3-(3,4-dichlorophenyl)-4,5-dihydro-1H-pyrazol-4-yl]-N-ethyl-2-hydroxyacetamide
• (R)-BAY-598