Methanol → 4-Amino-2-[4-(1-cyclopenten-1-ylcarbonyl)piperazinyl]-6,7-dimethoxyquinazoline

반응식

[C:1]1([C:6](=[O:7])[N:8]2[CH2:9][CH2:10][NH:11][CH2:12][CH2:13]2)=[CH:2][CH2:3][CH2:4][CH2:5]1.[CH3:30][OH:31].[Cl:14][c:15]1[n:16][c:17]2[cH:18][c:19]([O:28][CH3:29])[c:20]([O:26][CH3:27])[cH:21][c:22]2[c:23]([NH2:25])[n:24]1>>[C:1]1([C:6](=[O:7])[N:8]2[CH2:9][CH2:10][N:11]([c:15]3[n:16][c:17]4[cH:18][c:19]([O:28][CH3:29])[c:20]([O:26][CH3:27])[cH:21][c:22]4[c:23]([NH2:25])[n:24]3)[CH2:12][CH2:13]2)=[CH:2][CH2:3][CH2:4][CH2:5]1

참가 물질

반응물 3

HCID 887Methanol

HCID 902352-Chloro-6,7-dimethoxy-4-quinazolinamine

HCID 21183998N-(1-cyclopenten-1-ylcarbonyl)piperazine

생성물 1

HCID 211839024-Amino-2-[4-(1-cyclopenten-1-ylcarbonyl)piperazinyl]-6,7-dimethoxyquinazoline

출처 및 근거

ORD 기록: ord-19bb0a56de2a42bcae749f82aa4fb13d
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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