Cyclopropylboronic acid → tert-Butyl 2-(6-(2-cyclopropylphenyl)-5-methylpyridin-3-ylamino)-5-methylbenzoate

반응식

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

참가 물질

반응물 2

HCID 2760897Cyclopropylboronic acid

HCID 25187848Tert-butyl 2-(6-(2-chlorophenyl)-5-methylpyridin-3-ylamino)-5-methylbenzoate

생성물 1

HCID 86657265tert-Butyl 2-(6-(2-cyclopropylphenyl)-5-methylpyridin-3-ylamino)-5-methylbenzoate

출처 및 근거

ORD 기록: ord-f443c3c9098443218fe733abbae2e472
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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