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

Triethylamine → HCID 54689839, 화합물

HRID 1244116
노트
인쇄 미리보기

반응식

HRID 1244116 반응식
[C:1]([C:3]1[C:8](=[O:9])[NH:7][C:6]2[S:10][CH:11]=[C:12]([C:13]3[CH:18]=[CH:17][C:16]([C:19]#[C:20][CH2:21][CH2:22][CH2:23][CH2:24][C:25]([OH:27])=O)=[CH:15][CH:14]=3)[C:5]=2[C:4]=1[OH:28])#[N:2].C1C=CC2N(O)N=NC=2C=1.CN(C(ON1N=NC2C=CC=CC1=2)=[N+](C)C)C.[B-](F)(F)(F)F.[CH3:61][CH2:62][N:63](CC)[CH2:64][CH3:65]>CN(C=O)C>[CH2:62]([N:63]([CH2:64][CH3:65])[C:25](=[O:27])[CH2:24][CH2:23][CH2:22][CH2:21][C:20]#[C:19][C:16]1[CH:15]=[CH:14][C:13]([C:12]2[C:5]3[C:4]([OH:28])=[C:3]([C:1]#[N:2])[C:8](=[O:9])[NH:7][C:6]=3[S:10][CH:11]=2)=[CH:18][CH:17]=1)[CH3:61]
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

6

반응물 4

HCID 8471TriethylamineHCID 757711-HydroxybenzotriazoleHCID 2733207O-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborateHCID 54689836HCID 54689836, 화합물

생성물 1

HCID 54689839HCID 54689839, 화합물

시약·촉매·용매 1

HCID 6228
Dimethylformamide
용매

실험 절차

To a solution of 7-[4-(5-cyano-4-hydroxy-6-oxo-6,7-dihydro-thieno[2,3-b]pyridin-3-yl)-phenyl]-hept-6-ynoic acid (24 mg, 0.06 mmol) in 0.5 mL DMF was added HOBT (trace) followed by TBTU (23 mg, 0.07 mmol). The pH of the reaction mixture was adjusted to pH>6 using Et3N, then stirred at rt overnight. Solvent was removed in vacuo, the resulting slurry was redissolved in MeOH and purified using reverse phase HPLC to afford the titled compound. MS (ESI) m/e 448 (M+H)+; 1H NMR (400 MHz, DMSO-d6): δ 1.00 (t, J=8.1 Hz, 3H), 1.10 (t, J=8.1 Hz, 3H), 1.58–1.68 (m, 4H), 2.33 (t, J=6.90 Hz, 2H), 2.45 (t, J=6.90 Hz, 2H), 3.23–3.33 (m, 4H), 6.65 (s, 1H), 7.26 (d, J=8.59 Hz, 2H), 7.42 (d, J=8.59 Hz, 2H).

후처리

  1. customSolvent was removed in vacuo
  2. dissolutionthe resulting slurry was redissolved in MeOH
  3. custompurified

출처 및 근거

ORD 기록
ord-40940afcd83d4b878ef21a203625d751
출처 데이터셋
uspto-grants-2006_10
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07119205B2

반응 노트

불러오는 중…

이 페이지에서참가 물질실험 절차후처리출처 및 근거반응 노트