Ethanol → 4-(6,7-Dimethoxy-quinazolin-4-yl)-piperidine-1-carboxylic acid (4-pyrimidin-5-yl-phenyl)-amide
Reaction equation
[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[CH3:53][CH2:54][OH:55].[I:1][c:2]1[cH:3][cH:4][c:5]([NH:8][C:9](=[O:10])[N:11]2[CH2:12][CH2:13][CH:14]([c:17]3[n:18][cH:19][n:20][c:21]4[cH:22][c:23]([O:29][CH3:30])[c:24]([O:27][CH3:28])[cH:25][c:26]34)[CH2:15][CH2:16]2)[cH:6][cH:7]1.[K+:40].[K+:41].[O-:42][C:43]([O-:44])=[O:45].[cH:56]1[cH:57][cH:58][c:59]([P:60]([Pd:61]([P:62]([c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)([c:69]2[cH:70][cH:71][cH:72][cH:73][cH:74]2)[c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)([P:81]([c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)([c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)[c:94]2[cH:95][cH:96][cH:97][cH:98][cH:99]2)[P:100]([c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)([c:107]2[cH:108][cH:109][cH:110][cH:111][cH:112]2)[c:113]2[cH:114][cH:115][cH:116][cH:117][cH:118]2)([c:119]2[cH:120][cH:121][cH:122][cH:123][cH:124]2)[c:125]2[cH:126][cH:127][cH:128][cH:129][cH:130]2)[cH:131][cH:132]1.[n:31]1[cH:32][n:33][cH:34][c:35]([B:37]([OH:38])[OH:39])[cH:36]1>>[c:2]1(-[c:35]2[cH:34][n:33][cH:32][n:31][cH:36]2)[cH:3][cH:4][c:5]([NH:8][C:9](=[O:10])[N:11]2[CH2:12][CH2:13][CH:14]([c:17]3[n:18][cH:19][n:20][c:21]4[cH:22][c:23]([O:29][CH3:30])[c:24]([O:27][CH3:28])[cH:25][c:26]34)[CH2:15][CH2:16]2)[cH:6][cH:7]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-77848714b86548528926287bf257e976
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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