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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Water → N-(2-{1-[(5-Chloro-2,4-dimethoxy-phenylcarbamoyl)-methyl]-2,4-dioxo-1,4-dihydro-2H-quinazolin-3-yl}-ethyl)-3-methyl-butyramide

HRID 472736
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HRID 472736 반응식
FC(F)(F)C(O)=O.[NH2:8][CH2:9][CH2:10][N:11]1[C:20](=[O:21])[C:19]2[C:14](=[CH:15][CH:16]=[CH:17][CH:18]=2)[N:13]([CH2:22][C:23]([NH:25][C:26]2[CH:31]=[C:30]([Cl:32])[C:29]([O:33][CH3:34])=[CH:28][C:27]=2[O:35][CH3:36])=[O:24])[C:12]1=[O:37].[C:38](Cl)(=[O:43])[CH2:39][CH:40]([CH3:42])[CH3:41].O>C1COCC1.C(N(CC)CC)C>[Cl:32][C:30]1[C:29]([O:33][CH3:34])=[CH:28][C:27]([O:35][CH3:36])=[C:26]([NH:25][C:23]([CH2:22][N:13]2[C:14]3[C:19](=[CH:18][CH:17]=[CH:16][CH:15]=3)[C:20](=[O:21])[N:11]([CH2:10][CH2:9][NH:8][C:38](=[O:43])[CH2:39][CH:40]([CH3:42])[CH3:41])[C:12]2=[O:37])=[O:24])[CH:31]=1
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참가 물질

6

반응물 3

HCID 962WaterHCID 66054Isovaleryl chlorideHCID 685885032-[3-(2-Amino-ethyl)-2,4-dioxo-3,4-dihydro-2H-quinazolin-1-yl]-N-(5-chloro-2,4-dimethoxy-phenyl)-acetamide trifluoroacetate

생성물 1

HCID 59317713N-(2-{1-[(5-Chloro-2,4-dimethoxy-phenylcarbamoyl)-methyl]-2,4-dioxo-1,4-dihydro-2H-quinazolin-3-yl}-ethyl)-3-methyl-butyramide

시약·촉매·용매 2

HCID 8028
Tetrahydrofuran
용매
HCID 8471Triethylamine용매

실험 절차

To a suspension of 2-[3-(2-amino-ethyl)-2,4-dioxo-3,4-dihydro-2H-quinazolin-1-yl]-N-(5-chloro-2,4-dimethoxy-phenyl)-acetamide trifluoroacetate (75 mg, 0.17 mmol) in THF (1 ml), triethylamine is added (0.06 ml, 0.43 mmol) followed by isovaleryl chloride (30 mg, 0.26 mmol). The mixture is stirred overnight at RT and then treated with water (3 ml). The resulting solid is filtered and washed with water to afford the title compound; [M+H]+ 517.3.

후처리

  1. additionis added (0.06 ml, 0.43 mmol)
  2. filtrationThe resulting solid is filtered
  3. washwashed with water

출처 및 근거

ORD 기록
ord-230534be6159401087b6977478e26c8c
출처 데이터셋
uspto-grants-2014_01
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08633211B2

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