4-[4-[4-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]piperazin-1-yl]phenyl]-2-[[4-(trifluoromethyl)phenyl]methyl]-1,2,4-triazol-3-one

• 常用名: 4-[4-[4-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]piperazin-1-yl]phenyl]-2-[[4-(trifluoromethyl)phenyl]methyl]-1,2,4-triazol-3-one
• 英文名: 4-[4-[4-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]piperazin-1-yl]phenyl]-2-[[4-(trifluoromethyl)phenyl]methyl]-1,2,4-triazol-3-one
• CAS号: 210562-94-0
• 分子量: 654.63300
• 密度: N/A
• 沸点: N/A
• 分子式: C₃₂H₃₁F₅N₈O₂
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: 4-[4-[4-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]piperazin-1-yl]phenyl]-2-[[4-(trifluoromethyl)phenyl]methyl]-1,2,4-triazol-3-one

物理化学性质

• 分子式: C₃₂H₃₁F₅N₈O₂
• 分子量: 654.63300
• 精确质量: 654.24900
• PSA: 97.24000
• LogP: 4.07220
• InChIKey: RKIFSGOQLRESME-JPZYQRIQSA-N
• SMILES: CC(N1CCN(c2ccc(-n3cnn(Cc4ccc(C(F)(F)F)cc4)c3=O)cc2)CC1)C(O)(Cn1cncn1)c1ccc(F)cc1F
• 蒸汽压: 1.18E-25mmHg at 25°C

英文别名

• 3H-1,2,4-Triazol-3-one,4-(4-(4-((1R,2R)-2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1H-1,2,4-triazol-1-yl)propyl)-1-piperazinyl)phenyl)-2,4-dihydro-2-((4-(trifluoromethyl)phenyl)methyl)
• SYN 2836