1-Propylethylenediamine → N-cyclopropyl-3-(8-(2,6-difluorophenyl)-7-oxo-2-{[2-(propylamino)ethyl]amino}-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl)-4-methylbenzamide

HRID 2140466

반응식

HRID 2140466 반응식
[CH2:37]([CH2:38][CH3:39])[NH:40][CH2:41][CH2:42][NH2:43].[CH:1]1([NH:4][C:5]([c:6]2[cH:7][c:8](-[c:13]3[c:14]4[c:15]([n:16][c:17]([S:19]([CH3:20])(=[O:21])=[O:22])[n:18]3)[n:23](-[c:28]3[c:29]([F:35])[cH:30][cH:31][cH:32][c:33]3[F:34])[c:24](=[O:27])[cH:25][cH:26]4)[c:9]([CH3:12])[cH:10][cH:11]2)=[O:36])[CH2:2][CH2:3]1>>[CH:1]1([NH:4][C:5]([c:6]2[cH:7][c:8](-[c:13]3[c:14]4[c:15]([n:16][c:17]([NH:43][CH2:42][CH2:41][NH:40][CH2:37][CH2:38][CH3:39])[n:18]3)[n:23](-[c:28]3[c:29]([F:35])[cH:30][cH:31][cH:32][c:33]3[F:34])[c:24](=[O:27])[cH:25][cH:26]4)[c:9]([CH3:12])[cH:10][cH:11]2)=[O:36])[CH2:2][CH2:3]1

참가 물질

3

반응물 2

HCID 660731-PropylethylenediamineHCID 57434545N-cyclopropyl-3-[8-(2,6-difluorophenyl)-2-(methylsulfonyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-4-methylbenzamide

생성물 1

HCID 11947934N-cyclopropyl-3-(8-(2,6-difluorophenyl)-7-oxo-2-{[2-(propylamino)ethyl]amino}-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl)-4-methylbenzamide

출처 및 근거

ORD 기록
ord-5ee59441aa904f3a8239b4dea403f3d4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

연결된 노트

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