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Hydrochloric Acid → Tert-butyl 2-[5-[[4-(1,3-benzothiazol-2-yloxy)phenyl]methyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]acetate

HRID 109729
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인쇄 미리보기

반응식

HRID 109729 반응식
[C:26]([CH3:27])([CH3:28])([CH3:29])[O:30][C:31]([CH2:32][Br:33])=[O:34].[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[CH3:42][C:43]#[N:44].[CH:2]12[N:3]([CH2:9][c:10]3[cH:11][cH:12][c:13]([O:14][c:15]4[s:16][c:17]5[c:18]([n:19]4)[cH:20][cH:21][cH:22][cH:23]5)[cH:24][cH:25]3)[CH2:4][CH:5]([NH:6][CH2:7]1)[CH2:8]2.[ClH:1]>>[CH:2]12[N:3]([CH2:9][c:10]3[cH:11][cH:12][c:13]([O:14][c:15]4[s:16][c:17]5[c:18]([n:19]4)[cH:20][cH:21][cH:22][cH:23]5)[cH:24][cH:25]3)[CH2:4][CH:5]([N:6]([CH2:32][C:31]([O:30][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:34])[CH2:7]1)[CH2:8]2
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 313Hydrochloric AcidHCID 6342AcetonitrileHCID 8471TriethylamineHCID 79177tert-Butyl bromoacetateHCID 672071422-[4-(2,5-Diazabicyclo[2.2.1]heptan-2-ylmethyl)phenoxy]-1,3-benzothiazole

생성물 1

HCID 57670764Tert-butyl 2-[5-[[4-(1,3-benzothiazol-2-yloxy)phenyl]methyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]acetate

출처 및 근거

ORD 기록
ord-f2f15d62fa7049d0a625b57e259aad71
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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