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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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m-Chloroperbenzoic acid → 4-(4-Cyano-2-methanesulfinyl-phenyl)-2,5-dioxo-1-(3-trifluoromethyl-phenyl)-1,4,5,6,7,8-hexahydro-2H-quinazoline-3-carboxylic acid methylamide

HRID 59660
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HRID 59660 반응식
ClC1C=C(C=CC=1)C(OO)=[O:6].[CH3:12][NH:13][C:14]([N:16]1[CH:25]([C:26]2[CH:31]=[CH:30][C:29]([C:32]#[N:33])=[CH:28][C:27]=2[S:34][CH3:35])[C:24]2[C:23](=[O:36])[CH2:22][CH2:21][CH2:20][C:19]=2[N:18]([C:37]2[CH:42]=[CH:41][CH:40]=[C:39]([C:43]([F:46])([F:45])[F:44])[CH:38]=2)[C:17]1=[O:47])=[O:15]>ClCCl>[CH3:12][NH:13][C:14]([N:16]1[CH:25]([C:26]2[CH:31]=[CH:30][C:29]([C:32]#[N:33])=[CH:28][C:27]=2[S:34]([CH3:35])=[O:6])[C:24]2[C:23](=[O:36])[CH2:22][CH2:21][CH2:20][C:19]=2[N:18]([C:37]2[CH:42]=[CH:41][CH:40]=[C:39]([C:43]([F:45])([F:44])[F:46])[CH:38]=2)[C:17]1=[O:47])=[O:15]
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

4

반응물 2

HCID 70297m-Chloroperbenzoic acidHCID 1186928894-(4-Cyano-2-methylsulfanyl-phenyl)-2,5-dioxo-1-(3-trifluoromethyl-phenyl)-1,4,5,6,7,8-hexahydro-2H-quinazoline-3-carboxylic acid methylamide2회

생성물 1

HCID 1186929114-(4-Cyano-2-methanesulfinyl-phenyl)-2,5-dioxo-1-(3-trifluoromethyl-phenyl)-1,4,5,6,7,8-hexahydro-2H-quinazoline-3-carboxylic acid methylamide

시약·촉매·용매 1

HCID 6344Dichloromethane
용매

실험 절차

3-Chloroperoxybenzoic acid (77%, 24 mg, 0.107 mmol) is added at room temperature to a solution of 4-(4-cyano-2-methylsulfanyl-phenyl)-2,5-dioxo-1-(3-trifluoromethyl-phenyl)-1,4,5,6,7,8-hexahydro-2H-quinazoline-3-carboxylic acid methylamide (INTERMEDIATE 8, 63 mg, 0.122 mmol) in dichloromethane (2 mL), and the mixture is stirred for 90 min. The reaction mixture is concentrated under reduced pressure and purified by reversed phase HPLC (X-Bridge C18, gradient of acetonitrile in water, 0.1% NH4OH) yielding the two diastereomers of the title compound.

후처리

  1. concentrationThe reaction mixture is concentrated under reduced pressure
  2. custompurified by reversed phase HPLC (X-Bridge C18, gradient of acetonitrile in water, 0.1% NH4OH)

출처 및 근거

ORD 기록
ord-ae4936b8b9084b3aa1e4010ab3104b11
출처 데이터셋
uspto-grants-2016_09
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US09440930B2

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