(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 |
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| 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 |
| 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 |
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| 分子式 | C25H24F5N5O2 |
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| 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 |
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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
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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
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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
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实验名称:Metabolic stability in human liver microsomes
来源:ChEMBL
靶标:Liver microsomes
External Id:CHEMBL898575
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实验名称:Bioavailability in dog at 5 mg/kg, po
来源:ChEMBL
靶标:Canis lupus familiaris
External Id:CHEMBL898601
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