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Benzyl Alcohol → (3-Benzyloxy-5-trifluoromethyl-benzyl)-(5'-isopropyl-2'-methoxy-4-trifluoromethyl-biphenyl-2-ylmethyl)-(5-morpholin-4-yl-pyrimidin-2-yl)-amine

HRID 1210295
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인쇄 미리보기

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HRID 1210295 반응식
[F:11][c:12]1[cH:13][c:14]([CH2:15][N:16]([c:17]2[n:18][cH:19][c:20]([N:23]3[CH2:24][CH2:25][O:26][CH2:27][CH2:28]3)[cH:21][n:22]2)[CH2:29][c:30]2[c:31](-[c:40]3[c:41]([O:49][CH3:50])[cH:42][cH:43][c:44]([CH:46]([CH3:47])[CH3:48])[cH:45]3)[cH:32][cH:33][c:34]([C:36]([F:37])([F:38])[F:39])[cH:35]2)[cH:51][c:52]([C:54]([F:55])([F:56])[F:57])[cH:53]1.[H-:1].[Na+:2].[O:58]1[CH2:59][CH2:60][CH2:61][CH2:62]1.[OH:3][CH2:4][c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1>>[O:3]([CH2:4][c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)[c:12]1[cH:13][c:14]([CH2:15][N:16]([c:17]2[n:18][cH:19][c:20]([N:23]3[CH2:24][CH2:25][O:26][CH2:27][CH2:28]3)[cH:21][n:22]2)[CH2:29][c:30]2[c:31](-[c:40]3[c:41]([O:49][CH3:50])[cH:42][cH:43][c:44]([CH:46]([CH3:47])[CH3:48])[cH:45]3)[cH:32][cH:33][c:34]([C:36]([F:37])([F:38])[F:39])[cH:35]2)[cH:51][c:52]([C:54]([F:55])([F:56])[F:57])[cH:53]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 244Benzyl AlcoholHCID 923Sodium IonHCID 8028TetrahydrofuranHCID 166653HydrideHCID 86626895HCID 86626895, 화합물

생성물 1

HCID 86626896(3-Benzyloxy-5-trifluoromethyl-benzyl)-(5'-isopropyl-2'-methoxy-4-trifluoromethyl-biphenyl-2-ylmethyl)-(5-morpholin-4-yl-pyrimidin-2-yl)-amine

출처 및 근거

ORD 기록
ord-3d31501389bf4d4b87387ef96aa39e1e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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