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Acetate → Tert-butyl 4-{2-[(3,5-bis-trifluoromethyl-phenyl)-(5'-isopropyl-2'-methoxy-4-trifluoromethyl-biphenyl-2-ylmethyl)-amino]-pyrimidin-5-yloxy}-butyrate

HRID 806177
Notes
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Reaction equation

HRID 806177 reaction equation
[Br:83][c:84]1[cH:85][c:86]([C:94]([F:95])([F:96])[F:97])[cH:87][c:88]([C:90]([F:91])([F:92])[F:93])[cH:89]1.[C:103]([O-:104])(=[O:105])[CH3:106].[C:98]([O-:99])(=[O:100])[CH3:101].[CH3:107][c:108]1[cH:109][cH:110][cH:111][cH:112][cH:113]1.[CH:43]([CH3:44])([CH3:45])[c:46]1[cH:47][cH:48][c:49]([O:81][CH3:82])[c:50](-[c:52]2[c:53]([CH2:62][NH:63][c:64]3[n:65][cH:66][c:67]([O:70][CH2:71][CH2:72][CH2:73][C:74](=[O:75])[O:76][C:77]([CH3:78])([CH3:79])[CH3:80])[cH:68][n:69]3)[cH:54][c:55]([C:58]([F:59])([F:60])[F:61])[cH:56][cH:57]2)[cH:51]1.[Pd+2:102].[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[c:9]2[c:10]3[c:34]([cH:35][cH:36][cH:37]2)[C:31]([CH3:32])([CH3:33])[c:13]2[c:12]([c:17]([P:18]([c:19]4[cH:20][cH:21][cH:22][cH:23][cH:24]4)[c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)[cH:16][cH:15][cH:14]2)[O:11]3)[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[CH:43]([CH3:44])([CH3:45])[c:46]1[cH:47][cH:48][c:49]([O:81][CH3:82])[c:50](-[c:52]2[c:53]([CH2:62][N:63]([c:64]3[n:65][cH:66][c:67]([O:70][CH2:71][CH2:72][CH2:73][C:74](=[O:75])[O:76][C:77]([CH3:78])([CH3:79])[CH3:80])[cH:68][n:69]3)[c:84]3[cH:85][c:86]([C:94]([F:95])([F:96])[F:97])[cH:87][c:88]([C:90]([F:91])([F:92])[F:93])[cH:89]3)[cH:54][c:55]([C:58]([F:59])([F:60])[F:61])[cH:56][cH:57]2)[cH:51]1
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 175Acetate2×HCID 1140TolueneHCID 676021-Bromo-3,5-bis(trifluoromethyl)benzeneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 6360441,1'-(9,9-Dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine)
HCID 66603218
Tert-butyl 4-{2-[(5'-isopropyl-2'-methoxy-4-trifluoromethyl-biphenyl-2-ylmethyl)-amino]-pyrimidin-5-yloxy}-butyrate

Product 1

HCID 86626893Tert-butyl 4-{2-[(3,5-bis-trifluoromethyl-phenyl)-(5'-isopropyl-2'-methoxy-4-trifluoromethyl-biphenyl-2-ylmethyl)-amino]-pyrimidin-5-yloxy}-butyrate

Sources & evidence

ORD record
ord-f7a33628714b4ec7ae3b20c26c0984f8
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes