Hydrochloric Acid → N1-(3-Fluoro-4-(2-(2-morpholinoethylamino)pyridin-4-yloxy)phenyl)-N3-(4-fluorophenyl)malonamide

HRID 1547422Notes

Reaction equation

HRID 1547422 reaction equation
[B-:55]([F:56])([F:57])([F:58])[F:59].[CH3:86][O:87][c:88]1[cH:89][cH:90][c:91]([CH2:92][NH:93][c:94]2[n:95][c:96]([O:97][c:98]3[cH:99][cH:100][c:101]([NH:102][C:108]([CH2:109][C:110](=[O:111])[NH:112][c:113]4[cH:114][cH:115][c:116]([F:119])[cH:117][cH:118]4)=[O:120])[cH:103][c:104]3[F:105])[cH:106][cH:107][n:121]2)[cH:122][cH:123]1.[CH:77]([N:78]([CH2:79][CH3:80])[CH:81]([CH3:82])[CH3:83])([CH3:84])[CH3:85].[ClH:25].[NH2:1][c:2]1[cH:3][c:4]([F:24])[c:5]([O:6][c:7]2[cH:8][c:9]([NH:13][CH2:14][CH2:15][N:16]3[CH2:17][CH2:18][O:19][CH2:20][CH2:21]3)[n:10][cH:11][cH:12]2)[cH:22][cH:23]1.[NH2:26][c:27]1[n:28][cH:29][n:30][c:31]([O:32][c:33]2[cH:34][cH:35][c:36]([NH:37][C:38]([NH:39][C:40](=[O:41])[CH2:42][c:43]3[cH:44][cH:45][c:46]([F:47])[cH:48][cH:49]3)=[S:50])[cH:51][c:52]2[F:53])[cH:54]1.[O:124]=[CH:125][N:126]([CH3:127])[CH3:128].[n:60]1([O:61][C:62]([N:63]([CH3:64])[CH3:65])=[N+:66]([CH3:67])[CH3:68])[c:69]2[cH:70][cH:71][cH:72][cH:73][c:74]2[n:75][n:76]1>>[NH:1]([c:2]1[cH:3][c:4]([F:24])[c:5]([O:6][c:7]2[cH:8][c:9]([NH:13][CH2:14][CH2:15][N:16]3[CH2:17][CH2:18][O:19][CH2:20][CH2:21]3)[n:10][cH:11][cH:12]2)[cH:22][cH:23]1)[C:108]([CH2:109][C:110](=[O:111])[NH:112][c:113]1[cH:114][cH:115][c:116]([F:119])[cH:117][cH:118]1)=[O:120]

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 26255TetrafluoroborateHCID 81531DiisopropylethylamineHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 115389121-(4-(6-Aminopyrimidin-4-yloxy)-3-fluorophenyl)-3-(2-(4-fluorophenyl)acetyl)thioureaHCID 59852883N1-(4-(2-(4-Methoxybenzylamino)pyrimidin-4-yloxy)-3-fluorophenyl)-N3-(4-fluorophenyl)malonamideHCID 598529154-(4-amino-2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)pyridin-2-amine

Product 1

HCID 59852917N1-(3-Fluoro-4-(2-(2-morpholinoethylamino)pyridin-4-yloxy)phenyl)-N3-(4-fluorophenyl)malonamide

Sources & evidence

ORD record
ord-85cba2b449094c4d817de36f2186604a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…