Tolylboronic acid → Methyl 2-(2-(furan-2-yl)-5-methyl-7-p-tolylpyrazolo[1,5-a]pyrimidin-6-yl)pentanoate

반응식

[CH3:25][c:26]1[cH:27][cH:28][c:29]([B:32]([OH:33])[OH:34])[cH:30][cH:31]1.[CH:35]([N:36]([CH:37]([CH3:38])[CH3:39])[CH2:40][CH3:41])([CH3:42])[CH3:43].[Cl:1][c:2]1[c:3]([CH:17]([C:18](=[O:19])[O:20][CH3:21])[CH2:22][CH2:23][CH3:24])[c:4]([CH3:16])[n:5][c:6]2[n:7]1[n:8][c:9](-[c:11]1[o:12][cH:13][cH:14][cH:15]1)[cH:10]2>>[c:2]1(-[c:29]2[cH:28][cH:27][c:26]([CH3:25])[cH:31][cH:30]2)[c:3]([CH:17]([C:18](=[O:19])[O:20][CH3:21])[CH2:22][CH2:23][CH3:24])[c:4]([CH3:16])[n:5][c:6]2[n:7]1[n:8][c:9](-[c:11]1[o:12][cH:13][cH:14][cH:15]1)[cH:10]2

참가 물질

반응물 3

HCID 79799Tolylboronic acid

HCID 81531Diisopropylethylamine

HCID 86674715Methyl 2-(7-chloro-2-(furan-2-yl)-5-methylpyrazolo[1,5-a]pyrimidin-6-yl)pentanoate

생성물 1

HCID 67257780Methyl 2-(2-(furan-2-yl)-5-methyl-7-p-tolylpyrazolo[1,5-a]pyrimidin-6-yl)pentanoate

출처 및 근거

ORD 기록: ord-2a076ab64b58474fb2620e478ba4fe41
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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