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Acetic Acid → 4-N-(3-chloro-4-fluorophenyl)-7-[3-methyl-3-(4-methylpiperazin-1-yl)but-1-ynyl]quinazoline-4,6-diamine

HRID 806301
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인쇄 미리보기

반응식

HRID 806301 반응식
[CH3:35][C:36](=[O:37])[OH:38].[CH3:45][CH2:46][OH:47].[Cl:1][c:2]1[cH:3][c:4]([NH:9][c:10]2[n:11][cH:12][n:13][c:14]3[cH:15][c:16]([C:23]#[C:24][C:25]([CH3:26])([N:27]4[CH2:28][CH2:29][N:30]([CH3:33])[CH2:31][CH2:32]4)[CH3:34])[c:17]([N+:20]([O-:21])=[O:22])[cH:18][c:19]23)[cH:5][cH:6][c:7]1[F:8].[Fe:48].[Na+:39].[Na+:40].[O-:41][C:42](=[O:43])[O-:44]>>[Cl:1][c:2]1[cH:3][c:4]([NH:9][c:10]2[n:11][cH:12][n:13][c:14]3[cH:15][c:16]([C:23]#[C:24][C:25]([CH3:26])([N:27]4[CH2:28][CH2:29][N:30]([CH3:33])[CH2:31][CH2:32]4)[CH3:34])[c:17]([NH2:20])[cH:18][c:19]23)[cH:5][cH:6][c:7]1[F:8]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 176Acetic AcidHCID 702EthanolHCID 923Sodium Ion2회HCID 19660Carbonate IonHCID 23925IronHCID 17864574HCID 17864574, 화합물

생성물 1

HCID 58998297
4-N-(3-chloro-4-fluorophenyl)-7-[3-methyl-3-(4-methylpiperazin-1-yl)but-1-ynyl]quinazoline-4,6-diamine

출처 및 근거

ORD 기록
ord-612c39f16f0146e9b05cf5dfaa772158
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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