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Hydrochloric Acid → Ethyl 3-(6-methyl-2-(1-(6-methylpyrimidin-4-yl)piperidin-4-ylamino)-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzylcarbamate

HRID 90942
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인쇄 미리보기

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HRID 90942 반응식
[CH:35]([N:36]([CH2:37][CH3:38])[CH:39]([CH3:40])[CH3:41])([CH3:42])[CH3:43].[Cl:44][C:45](=[O:46])[O:47][CH2:48][CH3:49].[Cl:50][CH2:51][Cl:52].[ClH:1].[ClH:2].[NH2:3][CH2:4][c:5]1[cH:6][c:7](-[c:11]2[c:12]3[n:13]([cH:14][c:15]([CH3:17])[cH:16]2)[n:18][c:19]([NH:21][CH:22]2[CH2:23][CH2:24][N:25]([c:28]4[n:29][cH:30][n:31][c:32]([CH3:34])[cH:33]4)[CH2:26][CH2:27]2)[n:20]3)[cH:8][cH:9][cH:10]1>>[NH:3]([CH2:4][c:5]1[cH:6][c:7](-[c:11]2[c:12]3[n:13]([cH:14][c:15]([CH3:17])[cH:16]2)[n:18][c:19]([NH:21][CH:22]2[CH2:23][CH2:24][N:25]([c:28]4[n:29][cH:30][n:31][c:32]([CH3:34])[cH:33]4)[CH2:26][CH2:27]2)[n:20]3)[cH:8][cH:9][cH:10]1)[C:45](=[O:46])[O:47][CH2:48][CH3:49]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 313Hydrochloric Acid2회HCID 6344DichloromethaneHCID 10928Ethyl chloroformateHCID 81531DiisopropylethylamineHCID 673424858-[3-(aminomethyl)phenyl]-6-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine

생성물 1

HCID 67344382
Ethyl 3-(6-methyl-2-(1-(6-methylpyrimidin-4-yl)piperidin-4-ylamino)-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzylcarbamate

출처 및 근거

ORD 기록
ord-ec6a1c0a513649fd8fcc15a4bfccd834
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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