2-Phenylbenzimidazole → 2-(1-((9-methyl-6-morpholino-2-(2-phenyl-1H-benzo[d]imidazol-1-yl)-9H-purin-8-yl)methyl)piperidin-4-yl)propan-2-ol

HRID 161807

반응식

HRID 161807 반응식
[Cl:1][c:2]1[n:3][c:4]([N:23]2[CH2:24][CH2:25][O:26][CH2:27][CH2:28]2)[c:5]2[n:6][c:7]([CH2:12][N:13]3[CH2:14][CH2:15][CH:16]([C:19]([CH3:20])([CH3:21])[OH:22])[CH2:17][CH2:18]3)[n:8]([CH3:11])[c:9]2[n:10]1.[c:29]1(-[c:35]2[nH:36][c:37]3[c:38]([n:39]2)[cH:40][cH:41][cH:42][cH:43]3)[cH:30][cH:31][cH:32][cH:33][cH:34]1>>[c:2]1(-[n:36]2[c:35](-[c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[n:39][c:38]3[c:37]2[cH:43][cH:42][cH:41][cH:40]3)[n:3][c:4]([N:23]2[CH2:24][CH2:25][O:26][CH2:27][CH2:28]2)[c:5]2[n:6][c:7]([CH2:12][N:13]3[CH2:14][CH2:15][CH:16]([C:19]([CH3:20])([CH3:21])[OH:22])[CH2:17][CH2:18]3)[n:8]([CH3:11])[c:9]2[n:10]1

참가 물질

3

반응물 2

HCID 128552-PhenylbenzimidazoleHCID 596034262-(1-((2-chloro-9-methyl-6-morpholino-9H-purin-8-yl)methyl)piperidin-4-yl)propan-2-ol

생성물 1

HCID 498321082-(1-((9-methyl-6-morpholino-2-(2-phenyl-1H-benzo[d]imidazol-1-yl)-9H-purin-8-yl)methyl)piperidin-4-yl)propan-2-ol

출처 및 근거

ORD 기록
ord-7a35bfd327aa454dbdbefb591b943337
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

불러오는 중…