홈MCP워크벤치Skills
홈워크벤치알림마이페이지
llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
  1. 홈
  2. /반응

Hydrochloric Acid → 3-phenoxy-N-(4-(piperidin-4-ylmethyl)thiazol-2-yl)-5-(thieno[3,2-b]pyridin-7-ylthio)pyridin-2-amine dihydrochloride

HRID 335264
노트
인쇄 미리보기

반응식

HRID 335264 반응식
[ClH:1].O1CCOCC1.[O:8]([C:15]1[C:16]([NH:31][C:32]2[S:33][CH:34]=[C:35]([CH2:37][CH:38]3[CH2:43][CH2:42][N:41](C(OC(C)(C)C)=O)[CH2:40][CH2:39]3)[N:36]=2)=[N:17][CH:18]=[C:19]([S:21][C:22]2[CH:27]=[CH:26][N:25]=[C:24]3[CH:28]=[CH:29][S:30][C:23]=23)[CH:20]=1)[C:9]1[CH:14]=[CH:13][CH:12]=[CH:11][CH:10]=1>ClCCl.CO>[ClH:1].[ClH:1].[O:8]([C:15]1[C:16]([NH:31][C:32]2[S:33][CH:34]=[C:35]([CH2:37][CH:38]3[CH2:43][CH2:42][NH:41][CH2:40][CH2:39]3)[N:36]=2)=[N:17][CH:18]=[C:19]([S:21][C:22]2[CH:27]=[CH:26][N:25]=[C:24]3[CH:28]=[CH:29][S:30][C:23]=23)[CH:20]=1)[C:9]1[CH:14]=[CH:13][CH:12]=[CH:11][CH:10]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

6

반응물 3

HCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 57742604tert-butyl 4-((2-(3-phenoxy-5-(thieno[3,2-b]pyridin-7-ylthio)pyridin-2-Ylamino)thiazol-4-yl)methyl)piperidine-1-carboxylate

생성물 1

HCID 866315353-phenoxy-N-(4-(piperidin-4-ylmethyl)thiazol-2-yl)-5-(thieno[3,2-b]pyridin-7-ylthio)pyridin-2-amine dihydrochloride수율 98.5%

시약·촉매·용매 2

HCID 887
Methanol
용매
HCID 6344Dichloromethane용매

실험 절차

Added 4N HCl in dioxane (3.0 mL, 12.0 mmol) to a solution of tert-butyl 4-((2-(3-phenoxy-5-(thieno[3,2-b]pyridin-7-ylthio)pyridin-2-ylamino)thiazol-4-yl)methyl)piperidine-1-carboxylate (0.790 g, 1.25 mmol) in dichloromethane (4 mL) and methanol (4 mL). The reaction was stirred at ambient temperature for 3 hours. Concentrated, triturated with hexanes, filtered to afford the title compound (0.745 g, 98.5% yield) as a light yellow powder: 1H NMR (d6-DMSO) δ 9.13 (m, 1H), 8.89 (m, 1H), 8.67 (d, 1H), 8.51 (d, 1H), 8.47 (s, 1H), 7.80 (d, 1H), 7.57 (s, 1H), 7.42 (t, 2H), 7.16-7.23 (m, 4H), 6.91 (s, 1H), 3.21 (m, 2H), 2.80 (m, 2H), 2.60 (d, 2H), 1.95 (m, 1H), 1.76 (m, 2H), 1.45 (m, 2H).

후처리

  1. concentrationConcentrated
  2. customtriturated with hexanes
  3. filtrationfiltered

출처 및 근거

ORD 기록
ord-c9c1aa8733ef451bbb1ffffe0d375f63
출처 데이터셋
uspto-grants-2014_11
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08883828B2

반응 노트

불러오는 중…

이 페이지에서참가 물질실험 절차후처리출처 및 근거반응 노트