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N-(1,3-benzodioxol-5-yl)-3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide

更新时间:2026-01-04 17:53:24

N-(1,3-benzodioxol-5-yl)-3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide结构式
N-(1,3-benzodioxol-5-yl)-3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide结构式
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常用名 N-(1,3-benzodioxol-5-yl)-3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide 英文名 N-(1,3-benzodioxol-5-yl)-3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
CAS号 6066-93-9 分子量 470.85300
密度 1.75g/cm3 沸点 N/A
分子式 C19H14ClF3N4O3S 熔点 N/A
MSDS N/A 闪点 N/A

 名称

英文名 N-(1,3-benzodioxol-5-yl)-3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
英文别名 更多

 物理化学性质

密度 1.75g/cm3
分子式 C19H14ClF3N4O3S
分子量 470.85300
精确质量 470.04300
PSA 112.37000
LogP 4.48080
InChIKey VEVFPDOUKMMJFB-UHFFFAOYSA-N
SMILES O=C(Nc1ccc2c(c1)OCO2)c1nn2c(c1Cl)NC(c1cccs1)CC2C(F)(F)F
折射率 1.724

 合成线路

~54%

N-(1,3-benzodioxol-5-yl)-3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide结构式

N-(1,3-benzodio...

6066-93-9

文献:Park, Soobong; Hayes, Brittany L.; Marankan, Fatima; Mulhearn, Debbie C.; Wanna, Linda; Mesecar, Andrew D.; Santarsiero, Bernard D.; Johnson, Michael E.; Venton, Duane L. Journal of Medicinal Chemistry, 2003 , vol. 46, # 6 p. 936 - 953

~%

N-(1,3-benzodioxol-5-yl)-3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide结构式

N-(1,3-benzodio...

6066-93-9

文献:Kurtz Justus Liebigs Annalen der Chemie, 1951 , vol. 572, p. 23,56

~%

N-(1,3-benzodioxol-5-yl)-3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide结构式

N-(1,3-benzodio...

6066-93-9

文献:Kurtz Justus Liebigs Annalen der Chemie, 1951 , vol. 572, p. 23,56

~%

N-(1,3-benzodioxol-5-yl)-3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide结构式

N-(1,3-benzodio...

6066-93-9

文献:Vasil'eva,E.I.; Freidlina,R.Kh. Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation), 1966 , p. 237 - 240 Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, 1966 , p. 263 - 267

 靶点实验

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External Id:20130624FPNS3DACB
实验名称:Alphascreen assay for small molecules abrogating mHTT-CaM Interaction
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靶标:Huntingtin
External Id:KUHTS-Muma KU-CaM-Htt INH-01
实验名称:Cell-based high throughput primary assay to identify activators of GPR151
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id:GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
实验名称:AlphaScreen-based biochemical high throughput primary assay to identify activators of...
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靶标:N/A
External Id:FBW7_ACT_ALPHA_1536_1X%ACT PRUN
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External Id:MITF_INH_Alpha_1536_1X%INH PRUN
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 英文别名

5-diethylamino-valeronitrile
5-Diaethylamino-valeronitril
N-BENZO[1,3]DIOXOL-5-YL-7-CHLORO-4-THIOPHEN-2-YL-2-(TRIFLUOROMETHYL)-1,5,9-TRIAZABICYCLO[4.3.0]NONA-5,7-DIENE-8-CARBOXAMIDE
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