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Potassium Cation → Methyl 4-(7-(bis((2-(trimethylsilyl)ethoxy)methyl)amino)-3-(6-chloropyridin-3-yl)pyrazolo[1,5-a]pyrimidin-5-yl)cyclohexanecarboxylate

HRID 86225
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인쇄 미리보기

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HRID 86225 반응식
[CH3:25][O:26][C:27](=[O:28])[CH:29]1[CH2:30][CH2:31][CH:32]([c:35]2[n:36][c:37]3[n:38]([c:39]([N:41]([CH2:42][O:43][CH2:44][CH2:45][Si:46]([CH3:47])([CH3:48])[CH3:49])[CH2:50][O:51][CH2:52][CH2:53][Si:54]([CH3:55])([CH3:56])[CH3:57])[cH:40]2)[n:58][cH:59][c:60]3[I:61])[CH2:33][CH2:34]1.[Cl:1][c:2]1[n:3][cH:4][c:5]([B:8]2[O:9][C:10]([CH3:11])([CH3:12])[C:13]([CH3:14])([CH3:15])[O:16]2)[cH:6][cH:7]1.[K+:22].[K+:23].[K+:24].[O:62]1[CH2:63][CH2:64][O:65][CH2:66][CH2:67]1.[P:17]([O-:18])([O-:19])([O-:20])=[O:21]>>[Cl:1][c:2]1[n:3][cH:4][c:5](-[c:60]2[c:37]3[n:36][c:35]([CH:32]4[CH2:31][CH2:30][CH:29]([C:27]([O:26][CH3:25])=[O:28])[CH2:34][CH2:33]4)[cH:40][c:39]([N:41]([CH2:42][O:43][CH2:44][CH2:45][Si:46]([CH3:47])([CH3:48])[CH3:49])[CH2:50][O:51][CH2:52][CH2:53][Si:54]([CH3:55])([CH3:56])[CH3:57])[n:38]3[n:58][cH:59]2)[cH:6][cH:7]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 813Potassium Cation3회HCID 1061PhosphateHCID 312751,4-DioxaneHCID 27947192-Chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridineHCID 667384164-{7-[Bis-(2-trimethylsilanyl-ethoxymethyl)-amino]-3-iodo-pyrazolo[1,5-a]pyrimidin-5-yl}-cyclohexanecarboxylic acid methyl ester

생성물 1

HCID 86664799
Methyl 4-(7-(bis((2-(trimethylsilyl)ethoxy)methyl)amino)-3-(6-chloropyridin-3-yl)pyrazolo[1,5-a]pyrimidin-5-yl)cyclohexanecarboxylate

출처 및 근거

ORD 기록
ord-06cb6a035c1d47e9bce613e403604853
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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