Tetrahydrofuran → 2-(4-(4-((2-Methylpyridin-3-yloxy)methyl)-2H-1,2,3-triazol-2-yl)piperidin-1-yl)-5-(trifluoromethyl)pyrimidine

HRID 683339

반응식

HRID 683339 반응식
[CH2:51]1[O:52][CH2:53][CH2:54][CH2:55]1.[F:15][C:16]([c:17]1[cH:18][n:19][c:20]([N:23]2[CH2:24][CH2:25][CH:26]([OH:29])[CH2:27][CH2:28]2)[n:21][cH:22]1)([F:30])[F:31].[c:32]1([P:33]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:46][cH:47][cH:48][cH:49][cH:50]1.[nH:1]1[n:2][n:3][cH:4][c:5]1[CH2:6][O:7][c:8]1[c:9]([CH3:14])[n:10][cH:11][cH:12][cH:13]1>>[n:1]1[n:2]([CH:26]2[CH2:25][CH2:24][N:23]([c:20]3[n:19][cH:18][c:17]([C:16]([F:15])([F:30])[F:31])[cH:22][n:21]3)[CH2:28][CH2:27]2)[n:3][cH:4][c:5]1[CH2:6][O:7][c:8]1[c:9]([CH3:14])[n:10][cH:11][cH:12][cH:13]1

참가 물질

5

반응물 4

HCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 577084291-(5-(Trifluoromethyl)pyrimidin-2-yl)piperidin-4-olHCID 178432688HCID 178432688, 화합물

생성물 1

HCID 577083962-(4-(4-((2-Methylpyridin-3-yloxy)methyl)-2H-1,2,3-triazol-2-yl)piperidin-1-yl)-5-(trifluoromethyl)pyrimidine

출처 및 근거

ORD 기록
ord-bfe1ce90cf1449c58d715fc714a5a816
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

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