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Dichloromethane → tert-butyl N-[3-propan-2-yl-3-[4-[4-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carbonyl]cyclopentyl]carbamate

HRID 809552
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반응식

HRID 809552 반응식
[C:17]([CH3:18])([CH3:19])([CH3:20])[O:21][C:22](=[O:23])[NH:24][CH:25]1[CH2:26][C:27]([C:30](=[O:31])[OH:32])([CH:33]([CH3:34])[CH3:35])[CH2:28][CH2:29]1.[CH2:70]([Cl:71])[Cl:72].[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[N:1]1([c:7]2[n:8][cH:9][cH:10][c:11]([C:13]([F:14])([F:15])[F:16])[n:12]2)[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1.[P-:43]([F:44])([F:45])([F:46])([F:47])([F:48])[F:49].[n:50]1([O:51][P+:52]([N:53]([CH3:54])[CH3:55])([N:56]([CH3:57])[CH3:58])[N:59]([CH3:60])[CH3:61])[c:62]2[cH:63][cH:64][cH:65][cH:66][c:67]2[n:68][n:69]1>>[N:1]1([c:7]2[n:8][cH:9][cH:10][c:11]([C:13]([F:14])([F:15])[F:16])[n:12]2)[CH2:2][CH2:3][N:4]([C:30]([C:27]2([CH:33]([CH3:34])[CH3:35])[CH2:26][CH:25]([NH:24][C:22]([O:21][C:17]([CH3:18])([CH3:19])[CH3:20])=[O:23])[CH2:29][CH2:28]2)=[O:31])[CH2:5][CH2:6]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 124335Benzotriazol-1-yloxy-tris(dimethylamino)phosphoniumHCID 27783342-(Piperazin-1-yl)-4-(trifluoromethyl)pyrimidineHCID 235335173-(Tert-butoxycarbonylamino)-1-isopropylcyclopentanecarboxylic acid

생성물 1

HCID 72573889
tert-butyl N-[3-propan-2-yl-3-[4-[4-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carbonyl]cyclopentyl]carbamate

출처 및 근거

ORD 기록
ord-c22b3cab3b5d446d9d8bd2e29a586378
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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