4-Hydroxypyrrolidine → (4'-(4-(2-Methoxy-phenylsulfanyl)-3-trifluoromethyl-phenyl)-3,4,5,6-tetrahydro-2H-(1,2')bipyridinyl-3-yl)-methanol

HRID 666367노트

반응식

HRID 666367 반응식
[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6](-[c:8]2[cH:9][c:10]([C:23]([F:24])([F:25])[F:26])[c:11]([S:14][c:15]3[c:16]([O:21][CH3:22])[cH:17][cH:18][cH:19][cH:20]3)[cH:12][cH:13]2)[cH:7]1.[OH:27][CH:28]1[CH2:29][CH2:30][NH:31][CH2:32]1.[OH:33][CH2:34][CH:35]1[CH2:36][NH:37][CH2:38][CH2:39][CH2:40]1>>[c:2]1([N:37]2[CH2:36][CH:35]([CH2:34][OH:33])[CH2:40][CH2:39][CH2:38]2)[n:3][cH:4][cH:5][c:6](-[c:8]2[cH:9][c:10]([C:23]([F:24])([F:25])[F:26])[c:11]([S:14][c:15]3[c:16]([O:21][CH3:22])[cH:17][cH:18][cH:19][cH:20]3)[cH:12][cH:13]2)[cH:7]1

참가 물질

4

반응물 3

HCID 982104-HydroxypyrrolidineHCID 107308Piperidin-3-ylmethanolHCID 219068092-Chloro-4-(4-(2-methoxy-phenylsulfanyl)-3-trifluoromethyl-phenyl)-pyridine

생성물 1

HCID 21906789(4'-(4-(2-Methoxy-phenylsulfanyl)-3-trifluoromethyl-phenyl)-3,4,5,6-tetrahydro-2H-(1,2')bipyridinyl-3-yl)-methanol

출처 및 근거

ORD 기록
ord-4ab6ceb4b621450180ed29083737d41d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

반응 노트

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