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(2S)-6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2-(3,5-difluorophenyl)-2-methyl-4-(4,4,4-trifluorobutyl)-3,4-dihydro-2H-1,4-benzoxazin-3-one

更新时间:2026-02-23 23:52:47

(2S)-6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2-(3,5-difluorophenyl)-2-methyl-4-(4,4,4-trifluorobutyl)-3,4-dihydro-2H-1,4-benzoxazin-3-one结构式
(2S)-6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2-(3,5-difluorophenyl)-2-methyl-4-(4,4,4-trifluorobutyl)-3,4-dihydro-2H-1,4-benzoxazin-3-one结构式
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常用名 (2S)-6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2-(3,5-difluorophenyl)-2-methyl-4-(4,4,4-trifluorobutyl)-3,4-dihydro-2H-1,4-benzoxazin-3-one 英文名 (2S)-6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2-(3,5-difluorophenyl)-2-methyl-4-(4,4,4-trifluorobutyl)-3,4-dihydro-2H-1,4-benzoxazin-3-one
CAS号 949009-66-9 分子量 521.5
密度 N/A 沸点 N/A
分子式 C25H24F5N5O2 熔点 N/A
MSDS N/A 闪点 N/A

 名称

英文名 (2S)-6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2-(3,5-difluorophenyl)-2-methyl-4-(4,4,4-trifluorobutyl)-3,4-dihydro-2H-1,4-benzoxazin-3-one

 物理化学性质

分子式 C25H24F5N5O2
分子量 521.5
InChIKey UERMDDSMFCIPGD-DEOSSOPVSA-N
SMILES CCC1=C(C(=NC(=N1)N)N)C2=CC3=C(C=C2)O[C@@](C(=O)N3CCCC(F)(F)F)(C)C4=CC(=CC(=C4)F)F

 靶点实验

查看更多实验

实验名称:Half life in rat at 1 mg/kg, iv or 10 mg/kg, po
来源:ChEMBL
靶标:Rattus norvegicus
External Id:CHEMBL898593
实验名称:Half life in rat
来源:ChEMBL
靶标:Rattus norvegicus
External Id:CHEMBL1285381
实验名称:Half life in dog
来源:ChEMBL
靶标:Canis lupus familiaris
External Id:CHEMBL1285382
实验名称:Clearance in rat at 1 mg/kg, iv or 10 mg/kg, po
来源:ChEMBL
靶标:Rattus norvegicus
External Id:CHEMBL898591
实验名称:Volume of distribution at steady state in rat at 1 mg/kg, iv or 10 mg/kg, po
来源:ChEMBL
靶标:Rattus norvegicus
External Id:CHEMBL898592
实验名称:Metabolic stability in human liver microsomes
来源:ChEMBL
靶标:Liver microsomes
External Id:CHEMBL898575
实验名称:Bioavailability in dog at 5 mg/kg, po
来源:ChEMBL
靶标:Canis lupus familiaris
External Id:CHEMBL898601
实验名称:Inhibition of human recombinant renin in buffer
来源:ChEMBL
靶标:Renin
External Id:CHEMBL1285355
实验名称:Bioavailability in rat at 10 mg/kg, po
来源:ChEMBL
靶标:Rattus norvegicus
External Id:CHEMBL898602
实验名称:Oral bioavailability in rat
来源:ChEMBL
靶标:Rattus norvegicus
External Id:CHEMBL1285361
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