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Hydrochloric Acid → Hydrochloric Acid

HRID 123945
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인쇄 미리보기

반응식

HRID 123945 반응식
[CH3:1][n:2]1[n:3][cH:4][c:5]([CH2:8][N:9]2[CH2:10][CH2:11][N:12]([c:15]3[n:16][cH:17][cH:18][n:19][c:20]3-[c:21]3[cH:22][cH:23][c:24]([CH2:25][NH2:26])[cH:27][cH:28]3)[CH2:13][CH2:14]2)[c:6]1[CH3:7].[CH3:29][CH2:30][N:31]([CH2:32][CH3:33])[CH2:34][CH3:35].[CH3:45][C:46]#[N:47].[Cl:36][C:37](=[O:38])[O:39][CH3:40].[Cl:42][CH2:43][Cl:44].[ClH:41].[OH2:48]>>[CH3:1][n:2]1[n:3][cH:4][c:5]([CH2:8][N:9]2[CH2:10][CH2:11][N:12]([c:15]3[n:16][cH:17][cH:18][n:19][c:20]3-[c:21]3[cH:22][cH:23][c:24]([CH2:25][NH:26][C:37](=[O:38])[O:39][CH3:40])[cH:27][cH:28]3)[CH2:13][CH2:14]2)[c:6]1[CH3:7].[ClH:36]
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 7

HCID 313Hydrochloric AcidHCID 962WaterHCID 6342AcetonitrileHCID 6344DichloromethaneHCID 6586Methyl chloroformateHCID 8471TriethylamineHCID 593220094-[4-(1,5-dimethyl-1H-pyrazol-4-ylmethyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyrazinyl-3'-yl]-benzylamine

생성물

2
HCID 313Hydrochloric AcidHCID 59321909methyl N-[[4-[3-[4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazin-2-yl]phenyl]methyl]carbamate

출처 및 근거

ORD 기록
ord-6ad06654cdc44cc0bd9d3721488516b8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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