Sodium ion → 1-(4-(5-(4-(Difluoromethoxy)phenyl)pyrimidin-2-ylamino)phenethyl)piperidine-4-carboxylic acid
Reaction equation
[Br:1][c:2]1[cH:3][n:4][c:5]([NH:8][c:9]2[cH:10][cH:11][c:12]([CH2:13][CH2:14][N:15]3[CH2:16][CH2:17][CH:18]([C:21](=[O:22])[OH:23])[CH2:19][CH2:20]3)[cH:24][cH:25]2)[n:6][cH:7]1.[C:45](=[O:46])([O-:47])[O-:48].[CH2:51]1[O:52][CH2:53][CH2:54][O:55][CH2:56]1.[F:26][CH:27]([O:28][c:29]1[cH:30][cH:31][c:32]([B:35]2[O:36][C:37]([CH3:38])([CH3:39])[C:40]([CH3:41])([CH3:42])[O:43]2)[cH:33][cH:34]1)[F:44].[Na+:49].[Na+:50].[cH:57]1[cH:58][cH:59][c:60]([P:61]([Pd:62]([P:63]([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)([P:82]([c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)[c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[P:101]([c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)[c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)([c:120]2[cH:121][cH:122][cH:123][cH:124][cH:125]2)[c:126]2[cH:127][cH:128][cH:129][cH:130][cH:131]2)[cH:132][cH:133]1>>[c:2]1(-[c:32]2[cH:31][cH:30][c:29]([O:28][CH:27]([F:26])[F:44])[cH:34][cH:33]2)[cH:3][n:4][c:5]([NH:8][c:9]2[cH:10][cH:11][c:12]([CH2:13][CH2:14][N:15]3[CH2:16][CH2:17][CH:18]([C:21](=[O:22])[OH:23])[CH2:19][CH2:20]3)[cH:24][cH:25]2)[n:6][cH:7]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-0d0d39b9e6354be6a888c3e6a215e2f8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
Loading…