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Potassium Cation → 3-[5-(2-Fluoro-3-methoxy-phenyl)-pyridin-2-yloxy]-azetidine-1-carboxylic acid pyridazin-3-ylamide

HRID 1130473
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HRID 1130473 반응식
[C:34](=[O:35])([O-:36])[O-:37].[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[CH3:49][CH2:50][O:51][C:52](=[O:53])[CH3:54].[Cl:40][CH2:41][Cl:42].[F:1][c:2]1[c:3]([B:10]([OH:11])[OH:12])[cH:4][cH:5][cH:6][c:7]1[O:8][CH3:9].[K+:38].[K+:39].[OH2:48].[n:13]1[n:14][c:15]([NH:19][C:20](=[O:21])[N:22]2[CH2:23][CH:24]([O:26][c:27]3[n:28][cH:29][c:30]([Br:33])[cH:31][cH:32]3)[CH2:25]2)[cH:16][cH:17][cH:18]1>>[F:1][c:2]1[c:3](-[c:30]2[cH:29][n:28][c:27]([O:26][CH:24]3[CH2:23][N:22]([C:20]([NH:19][c:15]4[n:14][n:13][cH:18][cH:17][cH:16]4)=[O:21])[CH2:25]3)[cH:32][cH:31]2)[cH:4][cH:5][cH:6][c:7]1[O:8][CH3:9]
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 813Potassium Cation2회HCID 962WaterHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 49857442-Fluoro-3-methoxyphenylboronic acid
HCID 66710355
3-(5-Bromo-pyridin-2-yloxy)-azetidine-1-carboxylic acid pyridazin-3-ylamide

생성물 1

HCID 442189013-[5-(2-Fluoro-3-methoxy-phenyl)-pyridin-2-yloxy]-azetidine-1-carboxylic acid pyridazin-3-ylamide

출처 및 근거

ORD 기록
ord-41c720d07ebe400da60786a6d97873e7
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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