Hydrochloric Acid → N-(2,6-difluorophenyl)-3-[3-(2-{[2-(methyloxy)-4-(4-propyl-1-piperazinyl)phenyl]amino}-4-pyrimidinyl)imidazo[1,2-a]pyridin-2-yl]benzamide

HRID 1537233Notes

Reaction equation

HRID 1537233 reaction equation
[CH3:34][O:35][c:36]1[c:37]([NH2:51])[cH:38][cH:39][c:40]([N:42]2[CH2:43][CH2:44][N:45]([CH2:48][CH2:49][CH3:50])[CH2:46][CH2:47]2)[cH:41]1.[CH3:59][O-:60].[CH3:68][OH:69].[CH3:73][CH2:74][CH2:75][CH2:76][CH2:77][CH3:78].[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6](-[c:8]2[c:9](-[c:17]3[cH:18][c:19]([C:20](=[O:21])[NH:22][c:23]4[c:24]([F:30])[cH:25][cH:26][cH:27][c:28]4[F:29])[cH:31][cH:32][cH:33]3)[n:10][c:11]3[n:12]2[cH:13][cH:14][cH:15][cH:16]3)[n:7]1.[Cl:70][CH2:71][Cl:72].[ClH:52].[Na+:61].[O:53]1[CH2:54][CH2:55][O:56][CH2:57][CH2:58]1.[OH:62][CH2:63][C:64]([F:65])([F:66])[F:67]>>[c:2]1([NH:51][c:37]2[c:36]([O:35][CH3:34])[cH:41][c:40]([N:42]3[CH2:43][CH2:44][N:45]([CH2:48][CH2:49][CH3:50])[CH2:46][CH2:47]3)[cH:39][cH:38]2)[n:3][cH:4][cH:5][c:6](-[c:8]2[c:9](-[c:17]3[cH:18][c:19]([C:20](=[O:21])[NH:22][c:23]4[c:24]([F:30])[cH:25][cH:26][cH:27][c:28]4[F:29])[cH:31][cH:32][cH:33]3)[n:10][c:11]3[n:12]2[cH:13][cH:14][cH:15][cH:16]3)[n:7]1

Participants

11

Reactant 10

HCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium ionHCID 6344DichloromethaneHCID 64092,2,2-TrifluoroethanolHCID 8058HexaneHCID 312751,4-DioxaneHCID 3826051MethoxideHCID 594529693-[3-(2-chloro-4-pyrimidinyl)imidazo[1,2-a]pyridin-2-yl]-N-(2,6-difluorophenyl)-benzamideHCID 598602822-(Methyloxy)-4-(4-propyl-1-piperazinyl)aniline

Product 1

HCID 59452681N-(2,6-difluorophenyl)-3-[3-(2-{[2-(methyloxy)-4-(4-propyl-1-piperazinyl)phenyl]amino}-4-pyrimidinyl)imidazo[1,2-a]pyridin-2-yl]benzamide

Sources & evidence

ORD record
ord-6e9f1ee4532c42b291ee8c82cf99bf2f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…