Acetic Acid → 2-(N-(2-bromo-4-(2-propyl)phenyl)-N-ethylamino)-4-(morpholinomethyl)-6-methylpyrimidine

HRID 2343036Notes

Reaction equation

HRID 2343036 reaction equation
[BH3:29].[Br:1][c:2]1[c:3]([N:11]([c:12]2[n:13][c:14]([C:19](=[O:20])[N:21]3[CH2:22][CH2:23][O:24][CH2:25][CH2:26]3)[cH:15][c:16]([CH3:18])[n:17]2)[CH2:27][CH3:28])[cH:4][cH:5][c:6]([CH:8]([CH3:9])[CH3:10])[cH:7]1.[CH2:36]1[O:37][CH2:38][CH2:39][CH2:40]1.[CH3:30][C:31](=[O:32])[OH:33].[CH3:41][CH2:42][O:43][C:44]([CH3:45])=[O:46].[Na+:35].[OH-:34]>>[Br:1][c:2]1[c:3]([N:11]([c:12]2[n:13][c:14]([CH2:19][N:21]3[CH2:22][CH2:23][O:24][CH2:25][CH2:26]3)[cH:15][c:16]([CH3:18])[n:17]2)[CH2:27][CH3:28])[cH:4][cH:5][c:6]([CH:8]([CH3:9])[CH3:10])[cH:7]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 923Sodium ionHCID 961HydroxideHCID 6331BoraneHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 15490843N-(2-Bromo-4-(1-Methylethyl)Phenyl)-N-Ethyl-4-Methyl-6-(4-Morpholinylcarbonyl)-2-Pyrimidinamine

Product 1

HCID 102522822-(N-(2-bromo-4-(2-propyl)phenyl)-N-ethylamino)-4-(morpholinomethyl)-6-methylpyrimidine

Sources & evidence

ORD record
ord-e2820b01eaec44888772eebf33dec22e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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