4-Phenoxyphenylboronic acid → HCID 71092988, 화합물

HRID 1522163노트

반응식

HRID 1522163 반응식
Cl[C:2]1[C:3]([NH2:9])=[N:4][CH:5]=[N:6][C:7]=1Cl.[NH2:10][CH2:11][CH:12]1[CH2:18][CH:17]2[N:19]([C:20]([O:22]C(C)(C)C)=O)[CH:14]([CH2:15][CH2:16]2)[CH2:13]1.[O:27]([C:34]1[CH:39]=[CH:38][C:37](B(O)O)=[CH:36][CH:35]=1)[C:28]1[CH:33]=[CH:32][CH:31]=[CH:30][CH:29]=1.[CH3:43][N:44]([CH3:51])[CH2:45]/[CH:46]=[CH:47]/C(O)=O>>[NH2:9][C:3]1[N:4]=[CH:5][N:6]=[C:7]([NH:10][CH2:11][CH:12]2[CH2:13][CH:14]3[N:19]([C:20](=[O:22])/[CH:47]=[CH:46]/[CH2:45][N:44]([CH3:51])[CH3:43])[CH:17]([CH2:16][CH2:15]3)[CH2:18]2)[C:2]=1[C:31]1[CH:32]=[CH:33][C:28]([O:27][C:34]2[CH:39]=[CH:38][CH:37]=[CH:36][CH:35]=2)=[CH:29][CH:30]=1

참가 물질

5

반응물 4

HCID 27343774-Phenoxyphenylboronic acidHCID 14805664(2E)-4-(Dimethylamino)-2-butenoic acidHCID 242192625,6-Dichloro-pyrimidin-4-ylamineHCID 53487663HCID 53487663, 화합물

생성물 1

HCID 71092988HCID 71092988, 화합물

실험 절차

(E)-1-(3-(((6-amino-5-(4-phenoxyphenyl)pyrimidin-4-yl)amino)methyl)-8-azabicyclo[3.2.1]octan-8-yl)-4-(dimethylamino)but-2-en-1-one was prepared from 5,6-dichloropyrimidin-4-amine, tert-butyl 3-(aminomethyl)-8-azabicyclo[3.2.1]octane-8-carboxylate, (4-phenoxyphenyl)boronic acid, and (E)-4-(dimethylamino)but-2-enoic acid using methods B, C, D, and E. HPLC purity: 100%. MS: m/z=513 [M+H]+.

출처 및 근거

ORD 기록
ord-4b7a2f624fab45d5b5a9038a5d85aba1
출처 데이터셋
uspto-grants-2015_07
특허 번호
US09073947B2

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