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Potassium Cation → 4-(7-Azaindol-5-yloxy)-6-methoxy-7-(3-(4-methylsulphonylpiperazin-1-yl)propoxy)quinazoline

HRID 153377
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반응식

HRID 153377 반응식
[C:38](=[O:39])([O-:40])[O-:41].[Cl:1][c:2]1[n:3][cH:4][n:5][c:6]2[cH:7][c:8]([O:14][CH2:15][CH2:16][CH2:17][N:18]3[CH2:19][CH2:20][N:21]([S:24](=[O:25])(=[O:26])[CH3:27])[CH2:22][CH2:23]3)[c:9]([O:12][CH3:13])[cH:10][c:11]12.[K+:42].[K+:43].[O:44]=[CH:45][N:46]([CH3:47])[CH3:48].[OH:28][c:29]1[cH:30][c:31]2[cH:32][cH:33][nH:34][c:35]2[n:36][cH:37]1>>[c:2]1([O:28][c:29]2[cH:30][c:31]3[cH:32][cH:33][nH:34][c:35]3[n:36][cH:37]2)[n:3][cH:4][n:5][c:6]2[cH:7][c:8]([O:14][CH2:15][CH2:16][CH2:17][N:18]3[CH2:19][CH2:20][N:21]([S:24](=[O:25])(=[O:26])[CH3:27])[CH2:22][CH2:23]3)[c:9]([O:12][CH3:13])[cH:10][c:11]12
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 813Potassium Cation2회HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 220307221H-Pyrrolo[2,3-b]pyridin-5-olHCID 866180984-Chloro-6-methoxy-7-(3-(4-methylsulphonylpiperazin-1-yl)propoxy)quinazoline

생성물 1

HCID 10174598
4-(7-Azaindol-5-yloxy)-6-methoxy-7-(3-(4-methylsulphonylpiperazin-1-yl)propoxy)quinazoline

출처 및 근거

ORD 기록
ord-8aef97fd9db44cc6a8b04dacb7712f35
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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