N,N-Dimethylglycine → N1-{2-[(4-{[3-Chloro-4-(pyridin-2-ylmethoxy)phenyl]amino}quinazolin-5-yl)oxy]ethyl}-N2,N2-dimethylglycinamide

반응식

[CH3:1][N:2]([CH3:3])[CH2:4][C:5]([OH:6])=[O:7].[NH2:8][CH2:9][CH2:10][O:11][c:12]1[c:13]2[c:14]([NH:22][c:23]3[cH:24][c:25]([Cl:37])[c:26]([O:29][CH2:30][c:31]4[n:32][cH:33][cH:34][cH:35][cH:36]4)[cH:27][cH:28]3)[n:15][cH:16][n:17][c:18]2[cH:19][cH:20][cH:21]1>>[CH3:1][N:2]([CH3:3])[CH2:4][C:5](=[O:7])[NH:8][CH2:9][CH2:10][O:11][c:12]1[c:13]2[c:14]([NH:22][c:23]3[cH:24][c:25]([Cl:37])[c:26]([O:29][CH2:30][c:31]4[n:32][cH:33][cH:34][cH:35][cH:36]4)[cH:27][cH:28]3)[n:15][cH:16][n:17][c:18]2[cH:19][cH:20][cH:21]1

참가 물질

반응물 2

HCID 673N,N-Dimethylglycine

HCID 690577145-(2-aminoethoxy)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine

생성물 1

HCID 57974364N1-{2-[(4-{[3-Chloro-4-(pyridin-2-ylmethoxy)phenyl]amino}quinazolin-5-yl)oxy]ethyl}-N2,N2-dimethylglycinamide

출처 및 근거

ORD 기록: ord-fb46557caa9343149cc20fa3d01424ed
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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