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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Hydrochloric Acid → 4-bromo-2-(2-morpholin-4-yl-2-oxoethyl)-5-[(2,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl)amino]pyridazin-3-one

HRID 1237222
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HRID 1237222 반응식
[Br:1][c:2]1[c:3]([NH:13][CH:14]2[CH:15]([CH3:23])[CH:16]3[C:17]([CH3:21])([CH3:22])[CH:18]([CH2:19]2)[CH2:20]3)[cH:4][n:5][n:6]([CH2:9][C:10](=[O:11])[OH:12])[c:7]1=[O:8].[CH2:43]1[CH2:44][O:45][CH2:46][CH2:47][NH:48]1.[CH3:25][N:26]([CH3:27])[CH2:28][CH2:29][CH2:30][N:31]=[C:32]=[N:33][CH2:34][CH3:35].[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH3:49][N:50]([CH3:51])[CH:52]=[O:53].[CH3:54][CH2:55][O:56][C:57](=[O:58])[CH3:59].[ClH:24]>>[Br:1][c:2]1[c:3]([NH:13][CH:14]2[CH:15]([CH3:23])[CH:16]3[C:17]([CH3:21])([CH3:22])[CH:18]([CH2:19]2)[CH2:20]3)[cH:4][n:5][n:6]([CH2:9][C:10](=[O:11])[N:48]2[CH2:43][CH2:44][O:45][CH2:46][CH2:47]2)[c:7]1=[O:8]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 8083MorpholineHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 178430059HCID 178430059, 화합물

생성물 1

HCID 178430043
4-bromo-2-(2-morpholin-4-yl-2-oxoethyl)-5-[(2,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl)amino]pyridazin-3-one

출처 및 근거

ORD 기록
ord-8f30c563f8114247bfd1b1e059cd9ace
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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