Sodium ion → HCID 22346894, compound

HRID 684489Notes

Reaction equation

HRID 684489 reaction equation
[CH3:20][O:21][c:22]1[c:23]([NH:37][C:38](=[O:39])[c:40]2[n:41]([CH3:49])[c:42]3[cH:43][cH:44][cH:45][cH:46][c:47]3[cH:48]2)[cH:24][cH:25][c:26]([B:28]2[O:29][C:30]([CH3:31])([CH3:32])[C:33]([CH3:34])([CH3:35])[O:36]2)[cH:27]1.[CH3:56][O:57][CH2:58][CH2:59][O:60][CH3:61].[Na+:50].[Na+:51].[O-:52][C:53](=[O:54])[O-:55].[OH2:62].[cH:63]1[cH:64][cH:65][c:66]([P:67]([Pd:68]([P:69]([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)[c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)([P:88]([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)[c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)[P:107]([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)[c:132]2[cH:133][cH:134][cH:135][cH:136][cH:137]2)[cH:138][cH:139]1.[n:1]1([CH2:6][CH2:7][CH2:8][n:9]2[n:10][c:11]([I:19])[c:12]3[c:13]2[n:14][cH:15][n:16][c:17]3[NH2:18])[cH:2][n:3][cH:4][cH:5]1>>[n:1]1([CH2:6][CH2:7][CH2:8][n:9]2[n:10][c:11](-[c:26]3[cH:25][cH:24][c:23]([NH:37][C:38](=[O:39])[c:40]4[n:41]([CH3:49])[c:42]5[cH:43][cH:44][cH:45][cH:46][c:47]5[cH:48]4)[c:22]([O:21][CH3:20])[cH:27]3)[c:12]3[c:13]2[n:14][cH:15][n:16][c:17]3[NH2:18])[cH:2][n:3][cH:4][cH:5]1

Participants

8

Reactant 7

HCID 923Sodium ion2×HCID 962WaterHCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 22346911HCID 22346911, compoundHCID 22347095N-(2-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-1-methyl-1H-indole-2-carboxamideHCID 178420554HCID 178420554, compound

Product 1

HCID 22346894HCID 22346894, compound

Sources & evidence

ORD record
ord-d830b462df024bb7b8e8cb0bd967aa5e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…