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Hydrochloric Acid → HCID 178487402, 화합물

HRID 2149759
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HRID 2149759 반응식
[Br:37][c:38]1[n:39][nH:40][c:41]2[n:42][cH:43][n:44][c:45]([Cl:47])[c:46]12.[CH3:2][O:3][c:4]1[cH:5][c:6]2[c:7]([NH:23][CH:24]3[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]3)[cH:8][c:9](-[c:14]3[n:15][c:16]([N:20]([CH3:21])[CH3:22])[n:17][cH:18][cH:19]3)[cH:10][c:11]2[cH:12][cH:13]1.[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[CH3:53][CH2:54][O:55][C:56](=[O:57])[CH3:58].[Cl:59][CH2:60][Cl:61].[ClH:1].[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1>>[CH3:2][O:3][c:4]1[cH:5][c:6]2[c:7]([NH:23][CH:24]3[CH2:25][CH2:26][N:27]([c:45]4[n:44][cH:43][n:42][c:41]5[nH:40][n:39][c:38]([Br:37])[c:46]54)[CH2:28][CH2:29]3)[cH:8][c:9](-[c:14]3[n:15][c:16]([N:20]([CH3:21])[CH3:22])[n:17][cH:18][cH:19]3)[cH:10][c:11]2[cH:12][cH:13]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 532584094-[6-methoxy-4-(piperidin-4-ylamino)naphthalen-2-yl]-N,N-dimethylpyrimidin-2-amineHCID 1784783943-Bromo-4-chloro-1H-pyrazolo[3,4-d]pyrimidine

생성물 1

HCID 178487402HCID 178487402, 화합물

출처 및 근거

ORD 기록
ord-514e3d6f904a4f15967263649f4bf87f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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