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(2Z)-4-氧代-4-[3-(三氟甲基)-5,6-二氢-[1,2,4]三唑并[4,3-a]吡嗪-7(8H)-基]-1-(2,4,5-三氟苯基)丁-2-烯-2-胺
(Z)-3-amino-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)but-2-en-1-one
化合物简介
Sitagliptin intermediate. A dipeptidyl peptidase-4 inhibitor and an anti-hypertensive agent for the treatment of diabetes and hypertension.
基本信息
CAS:767340-03-4
中文别名:(2Z)-4-氧代-4-[3-(三氟甲基)-5,6-二氢-[1,2,4]三唑并[4,3-A]吡嗪-7(8H)-基]-1-(2,4,5-三氟苯基)-2-丁烯胺;(2Z)-2-氨基-4-氧-4-[3-(三氟甲基)-5,6-二氢[1,2,4]三唑[4,3-Α]吡嗪-7(8H)-基]-1-(2,4,5-三氟苯基)丁基-2-烯(2-4);西他列汀烯胺杂质;7(8H)-基]-1-(245-三氟苯基)丁-2-烯-2-胺;
英文别名:2-Buten-1-ol,4-[[(1,1-dimethylethyl)dimethylsilyl]oxy];2-Buten-1-ol,4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-,(Z);(2Z)-4-{[tert-butyl(dimethyl)silyl]oxy}but-2-en-1-ol;(2Z)-4-oxo-4-[3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-(2,4,5-trifluorophenyl)butan-2-en-2-amine;(2Z)-4-Oxo-4-[3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-yl]-1-(2,4,5-trifluorophenyl)but-2-en-2-amine;(Z)-4-(tert-butyl-dimethyl-silanyloxy)-but-2-en-1-ol;(Z)-3-amino-1-(3-trifluoromethyl-5,6-dihydro-8H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-4-(2,4,5-trifluorophenyl)but-2-en-1-one;(Z)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]-pyrazyn-7(8H)-yl)-4-(2,4,5-trifluorophenyl)but-2-en-1-one;cis-4-(1,1,2,2-tetramethyl-1-silapropoxy)but-2-en-1-ol;(2Z)-4-oxo-4-[3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-(2,4,5-trifluorophenyl)but-2-en-2-amine;(2Z)-4-(tert-butyldimethylsilanyloxy)but-2-en-1-ol;cis-4-(tert-butyldimethylsilanyloxy)-but-2-en-1-ol;
分子式:C16H13F6N5O
分子量:405.298
精确质量:405.102
Psa:77.04
Logp:2.7799
中文别名:(2Z)-4-氧代-4-[3-(三氟甲基)-5,6-二氢-[1,2,4]三唑并[4,3-A]吡嗪-7(8H)-基]-1-(2,4,5-三氟苯基)-2-丁烯胺;(2Z)-2-氨基-4-氧-4-[3-(三氟甲基)-5,6-二氢[1,2,4]三唑[4,3-Α]吡嗪-7(8H)-基]-1-(2,4,5-三氟苯基)丁基-2-烯(2-4);西他列汀烯胺杂质;7(8H)-基]-1-(245-三氟苯基)丁-2-烯-2-胺;
英文别名:2-Buten-1-ol,4-[[(1,1-dimethylethyl)dimethylsilyl]oxy];2-Buten-1-ol,4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-,(Z);(2Z)-4-{[tert-butyl(dimethyl)silyl]oxy}but-2-en-1-ol;(2Z)-4-oxo-4-[3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-(2,4,5-trifluorophenyl)butan-2-en-2-amine;(2Z)-4-Oxo-4-[3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-yl]-1-(2,4,5-trifluorophenyl)but-2-en-2-amine;(Z)-4-(tert-butyl-dimethyl-silanyloxy)-but-2-en-1-ol;(Z)-3-amino-1-(3-trifluoromethyl-5,6-dihydro-8H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-4-(2,4,5-trifluorophenyl)but-2-en-1-one;(Z)-3-amino-1-(3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]-pyrazyn-7(8H)-yl)-4-(2,4,5-trifluorophenyl)but-2-en-1-one;cis-4-(1,1,2,2-tetramethyl-1-silapropoxy)but-2-en-1-ol;(2Z)-4-oxo-4-[3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-(2,4,5-trifluorophenyl)but-2-en-2-amine;(2Z)-4-(tert-butyldimethylsilanyloxy)but-2-en-1-ol;cis-4-(tert-butyldimethylsilanyloxy)-but-2-en-1-ol;
分子式:C16H13F6N5O
分子量:405.298
精确质量:405.102
Psa:77.04
Logp:2.7799
编号系统
MDL号:MFCD12031551
物化性质
密度:1.6 g/cm3
沸点:555.1ºC at 760 mmHg
熔点:178-180ºC
折射率:1.59
储存条件:Refrigerator
沸点:555.1ºC at 760 mmHg
熔点:178-180ºC
折射率:1.59
储存条件:Refrigerator
安全信息
海关编码:2933990090
生产方法及用途
合成路线
上游原料
下游产品
图谱
13C NMR : Predict

1H NMR : Predict
