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Dimethylformamide → tert-butyl (1-(4-(9H-benzo[f]pyrido[2,3-b][1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)benzoyl)piperidin-4-yl)carbamate

HRID 1220354
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인쇄 미리보기

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HRID 1220354 반응식
[CH3:52][CH2:53][N:54]([CH2:55][CH3:56])[CH2:57][CH3:58].[CH3:78][CH2:79][O:80][C:81](=[O:82])[CH3:83].[NH:59]1[CH2:60][CH2:61][CH:62]([NH:65][C:66]([O:67][C:68]([CH3:69])([CH3:70])[CH3:71])=[O:72])[CH2:63][CH2:64]1.[O:73]=[CH:74][N:75]([CH3:76])[CH3:77].[P-:28]([F:29])([F:30])([F:31])([F:32])([F:33])[F:34].[n:1]1[n:2][c:3](-[c:19]2[cH:20][cH:21][c:22]([C:23](=[O:24])[OH:25])[cH:26][cH:27]2)[n:4]2[c:10]1-[c:9]1[c:8]([cH:14][cH:13][cH:12][cH:11]1)[NH:7][c:6]1[c:5]-2[cH:18][cH:17][cH:16][n:15]1.[n:35]1([O:36][C:37]([N:38]([CH3:39])[CH3:40])=[N+:41]([CH3:42])[CH3:43])[c:44]2[cH:45][cH:46][cH:47][cH:48][c:49]2[n:50][n:51]1>>[n:1]1[n:2][c:3](-[c:19]2[cH:20][cH:21][c:22]([C:23](=[O:24])[N:59]3[CH2:60][CH2:61][CH:62]([NH:65][C:66]([O:67][C:68]([CH3:69])([CH3:70])[CH3:71])=[O:72])[CH2:63][CH2:64]3)[cH:26][cH:27]2)[n:4]2[c:10]1-[c:9]1[c:8]([cH:14][cH:13][cH:12][cH:11]1)[NH:7][c:6]1[c:5]-2[cH:18][cH:17][cH:16][n:15]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 6228DimethylformamideHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 7238334-(N-Boc-amino)piperidineHCID 1361637624-(9H-benzo[f]pyrido[2,3-b][1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)benzoic acid

생성물 1

HCID 136163790tert-butyl (1-(4-(9H-benzo[f]pyrido[2,3-b][1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)benzoyl)piperidin-4-yl)carbamate

출처 및 근거

ORD 기록
ord-3a34027925c34d049481c57c2ce2e954
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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