Propanal → HCID 58603536, 화합물

HRID 2386474

반응식

HRID 2386474 반응식
[CH2:1]([N:3]([CH2:10][C:11]1[CH:12]=[C:13]([C:17]2[CH:22]=[CH:21][N:20]=[C:19]([NH:23][CH2:24][CH2:25][C:26]3[CH:31]=[CH:30][C:29]([OH:32])=[C:28]([F:33])[CH:27]=3)[N:18]=2)[CH:14]=[CH:15][CH:16]=1)[CH:4]1[CH2:9][CH2:8][NH:7][CH2:6][CH2:5]1)[CH3:2].[CH:34](=O)[CH2:35][CH3:36]>>[CH2:1]([N:3]([CH2:10][C:11]1[CH:12]=[C:13]([C:17]2[CH:22]=[CH:21][N:20]=[C:19]([NH:23][CH2:24][CH2:25][C:26]3[CH:31]=[CH:30][C:29]([OH:32])=[C:28]([F:33])[CH:27]=3)[N:18]=2)[CH:14]=[CH:15][CH:16]=1)[CH:4]1[CH2:5][CH2:6][N:7]([CH2:34][CH2:35][CH3:36])[CH2:8][CH2:9]1)[CH3:2]

참가 물질

3

반응물 2

HCID 527PropanalHCID 670456434-[2-(4-{3-[(Ethyl-piperidin-4-yl-amino)-methyl]-phenyl}-pyrimidin-2-ylamino)-ethyl]-2-fluoro-phenol

생성물 1

HCID 58603536HCID 58603536, 화합물

실험 절차

Intermediate 92 was coupled with propionaldehyde following procedure E. The product was purified by HPLC. LC-MS showed the product had the expected M+H+ of 492. 1H NMR (Varian 300 MHz, DMSO, shifts relative to the solvent peak at 2.50 ppm) δ 7.9 (d, 1H), 7.4-7.3 (m, 2H), 7.2 (t, 1H), 7.0-6.9 (m, 2H), 6.8 (m, 3H), 3.6 (s, 2H), 3.5 (d, 2H), 3.1 (m, 3H), 2.7 (q, 2H), 2.6 (m, 4H), 2.2 (t, 2H), 1.7-1.6 (m, 4H), 1.5-1.4 (m, 2H), 0.94 (t, 3H), 0.80 (t, 3H).

후처리

  1. customThe product was purified by HPLC

출처 및 근거

ORD 기록
ord-2e7eb9504d534465ba57fd3dc601c0eb
출처 데이터셋
uspto-grants-2012_09
특허 번호
US08268822B2

연결된 노트

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