(+/-)-2-[4-({[2-(Benzo[2,1,3]oxadiazol-5-yloxy)-pyridine-3-carbonyl]-amino}-methyl)-3-fluoro-phenoxy]-propionic acid tert-butyl ester → HCID 10115978, 화합물

HRID 1225006

반응식

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH:7]([CH3:8])[O:9][c:10]1[cH:11][c:12]([F:36])[c:13]([CH2:16][NH:17][C:18](=[O:19])[c:20]2[c:21]([O:26][c:27]3[cH:28][c:29]4[c:30]([n:31][s:32][n:33]4)[cH:34][cH:35]3)[n:22][cH:23][cH:24][cH:25]2)[cH:14][cH:15]1)=[O:37].[C:38]([O:39][C:40](=[O:41])[CH:42]([O:43][c:44]1[cH:45][cH:46][c:47]([CH2:48][NH:49][C:50]([c:51]2[c:52]([O:53][c:54]3[cH:55][cH:56][c:57]4[n:58][o:59][n:60][c:61]4[cH:62]3)[n:63][cH:64][cH:65][cH:66]2)=[O:67])[c:68]([F:69])[cH:70]1)[CH3:71])([CH3:72])([CH3:73])[CH3:74]>>[O:5]=[C:6]([CH:7]([CH3:8])[O:9][c:10]1[cH:11][c:12]([F:36])[c:13]([CH2:16][NH:17][C:18](=[O:19])[c:20]2[c:21]([O:26][c:27]3[cH:28][c:29]4[c:30]([n:31][s:32][n:33]4)[cH:34][cH:35]3)[n:22][cH:23][cH:24][cH:25]2)[cH:14][cH:15]1)[OH:37]

참가 물질

반응물 2

HCID 23529359(+/-)-2-[4-({[2-(Benzo[2,1,3]oxadiazol-5-yloxy)-pyridine-3-carbonyl]-amino}-methyl)-3-fluoro-phenoxy]-propionic acid tert-butyl ester

HCID 23529360(+)-2-[4-({[2-(Benzo[2,1,3]thiadiazol-5-yloxy)-pyridine-3-carbonyl]-amino}-methyl)-3-fluoro-phenoxy]-propionic acid tert-butyl ester

생성물 1

HCID 10115978HCID 10115978, 화합물

출처 및 근거

ORD 기록: ord-cff05c39c32b4cd0922b106bb995dd2e
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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