N-(1,1-Dimethylethyl)-1,3-propanediamine → 3-[8-(2,6-difluorophenyl)-2-({3-[(1,1-dimethylethyl)amino]propyl}amino)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-4-methyl-N-1,3-thiazol-2-ylbenzamide

HRID 175919

반응식

HRID 175919 반응식
[CH3:38][C:39]([CH3:40])([CH3:41])[NH:42][CH2:43][CH2:44][CH2:45][NH2:46].[F:1][c:2]1[c:3](-[n:9]2[c:10](=[O:37])[cH:11][cH:12][c:13]3[c:14]2[n:15][c:16]([S:34]([CH3:35])=[O:36])[n:17][c:18]3-[c:19]2[cH:20][c:21]([C:22](=[O:23])[NH:24][c:25]3[s:26][cH:27][cH:28][n:29]3)[cH:30][cH:31][c:32]2[CH3:33])[c:4]([F:8])[cH:5][cH:6][cH:7]1>>[F:1][c:2]1[c:3](-[n:9]2[c:10](=[O:37])[cH:11][cH:12][c:13]3[c:14]2[n:15][c:16]([NH:46][CH2:45][CH2:44][CH2:43][NH:42][C:39]([CH3:38])([CH3:40])[CH3:41])[n:17][c:18]3-[c:19]2[cH:20][c:21]([C:22](=[O:23])[NH:24][c:25]3[s:26][cH:27][cH:28][n:29]3)[cH:30][cH:31][c:32]2[CH3:33])[c:4]([F:8])[cH:5][cH:6][cH:7]1

참가 물질

3

반응물 2

HCID 40274N-(1,1-Dimethylethyl)-1,3-propanediamineHCID 574345493-[8-(2,6-difluorophenyl)-2-(methylsulfinyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-4-methyl-N-1,3-thiazol-2-ylbenzamide

생성물 1

HCID 592127293-[8-(2,6-difluorophenyl)-2-({3-[(1,1-dimethylethyl)amino]propyl}amino)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-4-methyl-N-1,3-thiazol-2-ylbenzamide

출처 및 근거

ORD 기록
ord-b189a420b3b2469a95b2e96f4b067e54
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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