Dichloromethane → Methyl 3-[({[1,6-diethyl-4-(tetrahydro-2H-pyran-4-ylamino)-1H-pyrazolo[3,4-b]pyridin-5-yl]methyl}amino)carbonyl]benzoate

HRID 181546

반응식

HRID 181546 반응식
[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]([C:8](=[O:9])[OH:10])[cH:11][cH:12][cH:13]1.[Cl:36][CH2:37][Cl:38].[NH2:14][CH2:15][c:16]1[c:17]([NH:29][CH:30]2[CH2:31][CH2:32][O:33][CH2:34][CH2:35]2)[c:18]2[c:19]([n:20][c:21]1[CH2:22][CH3:23])[n:24]([CH2:27][CH3:28])[n:25][cH:26]2>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]([C:8](=[O:10])[NH:14][CH2:15][c:16]2[c:17]([NH:29][CH:30]3[CH2:31][CH2:32][O:33][CH2:34][CH2:35]3)[c:18]3[c:19]([n:20][c:21]2[CH2:22][CH3:23])[n:24]([CH2:27][CH3:28])[n:25][cH:26]3)[cH:11][cH:12][cH:13]1

참가 물질

4

반응물 3

HCID 6344DichloromethaneHCID 6018803-(Methoxycarbonyl)benzoic acidHCID 596832145-(Aminomethyl)-1,6-diethyl-N-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-b]pyridin-4-amine

생성물 1

HCID 57813262Methyl 3-[({[1,6-diethyl-4-(tetrahydro-2H-pyran-4-ylamino)-1H-pyrazolo[3,4-b]pyridin-5-yl]methyl}amino)carbonyl]benzoate

출처 및 근거

ORD 기록
ord-d04c0fa157104a4c8ba00eeb66449bbf
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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