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Hydrochloric Acid → 7-((2-Chloro-6-methyl-4-pyridyl)methoxy)-4-(2-fluoro-5-methoxycarbonyloxy-4-methylanilino)-6-methoxyquinazoline

HRID 149179
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HRID 149179 반응식
[CH2:70]([Cl:71])[Cl:72].[Cl:60][c:61]1[n:62][c:63]([CH3:69])[cH:64][c:65]([CH2:67][OH:68])[cH:66]1.[ClH:13].[F:14][c:15]1[c:16]([NH:17][c:18]2[n:19][cH:20][n:21][c:22]3[cH:23][c:24]([OH:30])[c:25]([O:28][CH3:29])[cH:26][c:27]23)[cH:31][c:32]([O:36][C:37](=[O:38])[O:39][CH3:40])[c:33]([CH3:35])[cH:34]1.[O:1]=[C:2]([O:3][CH2:4][CH3:5])[N:6]=[N:7][C:8]([O:9][CH2:10][CH3:11])=[O:12].[c:41]1([P:42]([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[cH:55][cH:56][cH:57][cH:58][cH:59]1>>[F:14][c:15]1[c:16]([NH:17][c:18]2[n:19][cH:20][n:21][c:22]3[cH:23][c:24]([O:30][CH2:67][c:65]4[cH:64][c:63]([CH3:69])[n:62][c:61]([Cl:60])[cH:66]4)[c:25]([O:28][CH3:29])[cH:26][c:27]23)[cH:31][c:32]([O:36][C:37](=[O:38])[O:39][CH3:40])[c:33]([CH3:35])[cH:34]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 11776TriphenylphosphineHCID 220568ethyl N-ethoxycarbonyliminocarbamateHCID 22504306(2-Chloro-6-methylpyridin-4-yl)methanolHCID 1355493904-(2-Fluoro-5-methoxycarbonyloxy-4-methylanilino)-7-hydroxy-6-methoxyquinazoline

생성물 1

HCID 22624994
7-((2-Chloro-6-methyl-4-pyridyl)methoxy)-4-(2-fluoro-5-methoxycarbonyloxy-4-methylanilino)-6-methoxyquinazoline

출처 및 근거

ORD 기록
ord-3c76f1f4555f477abccfc913f8d0f11e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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