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Hydrochloric Acid → 8-fluoro-12-[3-(2-methoxyethyl)piperazin-1-yl]-6H-[1]benzothiolo[2,3-b][1,5]benzodiazepine

HRID 817164
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인쇄 미리보기

반응식

HRID 817164 반응식
[CH3:22][O:23][CH2:24][CH2:25][CH:26]1[NH:27][CH2:28][CH2:29][NH:30][CH2:31]1.[CH3:41][S:42]([CH3:43])=[O:44].[CH3:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[CH:32]([N:33]([CH:34]([CH3:35])[CH3:36])[CH2:37][CH3:38])([CH3:39])[CH3:40].[Cl:52][CH2:53][Cl:54].[ClH:1].[F:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([cH:21]1)[NH:8][c:9]1[s:10][c:11]3[c:12]([c:13]1[C:14]([NH2:16])=[N:15]2)[cH:17][cH:18][cH:19][cH:20]3>>[F:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([cH:21]1)[NH:8][c:9]1[s:10][c:11]3[c:12]([c:13]1[C:14]([N:16]1[CH2:29][CH2:28][NH:27][CH:26]([CH2:25][CH2:24][O:23][CH3:22])[CH2:31]1)=[N:15]2)[cH:17][cH:18][cH:19][cH:20]3
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 1140TolueneHCID 6344DichloromethaneHCID 81531DiisopropylethylamineHCID 178066642-(2-Methoxyethyl)piperazineHCID 1842238512-amino-8-fluoro-6H-[1]benzothieno[2,3-b][1,5]benzodiazepine

생성물

1
HCID 692118238-fluoro-12-[3-(2-methoxyethyl)piperazin-1-yl]-6H-[1]benzothiolo[2,3-b][1,5]benzodiazepine

출처 및 근거

ORD 기록
ord-19ab358eba1f47509c535eb7ce68bef7
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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