Hydrochloric Acid → HCID 67379165, compound

HRID 1114589Notes

Reaction equation

HRID 1114589 reaction equation
[CH:37]([N:38]([CH2:39][CH3:40])[CH:41]([CH3:42])[CH3:43])([CH3:44])[CH3:45].[Cl:29][c:30]1[n:31][cH:32][n:33][c:34]([CH3:36])[cH:35]1.[ClH:1].[ClH:2].[F:3][c:4]1[cH:5][c:6](-[c:11]2[c:12]3[n:13]([cH:14][cH:15][cH:16]2)[n:17][c:18]([NH:20][CH:21]2[CH:22]([O:27][CH3:28])[CH2:23][NH:24][CH2:25][CH2:26]2)[n:19]3)[cH:7][cH:8][c:9]1[F:10].[Na+:47].[O:48]1[CH2:49][CH2:50][O:51][CH2:52][CH2:53]1.[OH-:46]>>[F:3][c:4]1[cH:5][c:6](-[c:11]2[c:12]3[n:13]([cH:14][cH:15][cH:16]2)[n:17][c:18]([NH:20][CH:21]2[CH:22]([O:27][CH3:28])[CH2:23][N:24]([c:30]4[n:31][cH:32][n:33][c:34]([CH3:36])[cH:35]4)[CH2:25][CH2:26]2)[n:19]3)[cH:7][cH:8][c:9]1[F:10]

Participants

8

Reactant 7

HCID 313Hydrochloric Acid2×HCID 923Sodium ionHCID 961HydroxideHCID 312751,4-DioxaneHCID 81531DiisopropylethylamineHCID 5817964-Chloro-6-methylpyrimidineHCID 178493718HCID 178493718, compound

Product 1

HCID 67379165HCID 67379165, compound

Sources & evidence

ORD record
ord-f88f89edc9e44d27b77ce30d70acf2de
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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