1-[2-(4-Aminopiperidin-1-yl)ethyl]-7-methoxy-1,4-dihydro-2H-3,1-benzoxazin-2-one → 1-[2-(4-Aminopiperidin-1-yl)ethyl]-7-chloro-1,8-naphthyridin-2(1H)-one

반응식

[Cl:1][c:2]1[cH:3][cH:4][c:5]2[cH:6][cH:7][c:8](=[O:28])[n:9]([CH2:12][CH2:13][N:14]3[CH2:15][CH2:16][CH:17]([NH:20][C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[CH2:18][CH2:19]3)[c:10]2[n:11]1.[NH2:29][CH:30]1[CH2:31][CH2:32][N:33]([CH2:34][CH2:35][N:36]2[c:37]3[cH:38][c:39]([O:40][CH3:41])[cH:42][cH:43][c:44]3[CH2:45][O:46][C:47]2=[O:48])[CH2:49][CH2:50]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[cH:6][cH:7][c:8](=[O:28])[n:9]([CH2:12][CH2:13][N:14]3[CH2:15][CH2:16][CH:17]([NH2:20])[CH2:18][CH2:19]3)[c:10]2[n:11]1

참가 물질

반응물 2

HCID 667737621-[2-(4-Aminopiperidin-1-yl)ethyl]-7-methoxy-1,4-dihydro-2H-3,1-benzoxazin-2-one

HCID 86642642tert-Butyl{1-[2-(7-chloro-2-oxo-1,8-naphthyridin-1(2H)-yl)ethyl]piperidin-4-yl}carbamate

생성물 1

HCID 866426411-[2-(4-Aminopiperidin-1-yl)ethyl]-7-chloro-1,8-naphthyridin-2(1H)-one

출처 및 근거

ORD 기록: ord-e18dc522880948e69febfd20fda4eb9e
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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