1-(m-Tolyl)piperazine → Methyl {2-[4-(3-methylphenyl)piperazin-1-yl]-3-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrido[3,4-d]pyrimidin-4-yl}acetate

반응식

[CH3:26][c:27]1[cH:28][c:29]([N:33]2[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]2)[cH:30][cH:31][cH:32]1.[F:1][C:2]([c:3]1[cH:4][c:5]([N:9]=[C:10]=[N:11][c:12]2[cH:13][n:14][cH:15][cH:16][c:17]2[CH:18]=[CH:19][C:20](=[O:21])[O:22][CH3:23])[cH:6][cH:7][cH:8]1)([F:24])[F:25]>>[F:1][C:2]([c:3]1[cH:4][c:5]([N:9]2[C:10]([N:36]3[CH2:35][CH2:34][N:33]([c:29]4[cH:28][c:27]([CH3:26])[cH:32][cH:31][cH:30]4)[CH2:38][CH2:37]3)=[N:11][c:12]3[cH:13][n:14][cH:15][cH:16][c:17]3[CH:18]2[CH2:19][C:20](=[O:21])[O:22][CH3:23])[cH:6][cH:7][cH:8]1)([F:24])[F:25]

참가 물질

반응물 2

HCID 831111-(m-Tolyl)piperazine

HCID 90761513Methyl 3-[3-[[3-(trifluoromethyl)phenyl]iminomethylideneamino]-4-pyridinyl]prop-2-enoate

생성물 1

HCID 59168064Methyl {2-[4-(3-methylphenyl)piperazin-1-yl]-3-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrido[3,4-d]pyrimidin-4-yl}acetate

출처 및 근거

ORD 기록: ord-dd536d4d467d4ee497d6dcc6f69ce5b5
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

반응 노트

불러오는 중…