Sodium ion → N-cyclopropyl-4-methyl-3-(1-(2-methyl-3-oxopiperazin-1-yl)phthalazin-6-yl)benzamide

HRID 941634Notes

Reaction equation

HRID 941634 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[cH:5][n:6][n:7][c:8]([N:12]3[CH:13]([CH3:19])[C:14](=[O:18])[NH:15][CH2:16][CH2:17]3)[c:9]2[cH:10][cH:11]1.[CH3:48][O:49][CH2:50][CH2:51][O:52][CH3:53].[CH:20]1([NH:23][C:24]([c:25]2[cH:26][c:27]([B:32]3[O:33][C:34]([CH3:35])([CH3:36])[C:37]([CH3:38])([CH3:39])[O:40]3)[c:28]([CH3:31])[cH:29][cH:30]2)=[O:41])[CH2:21][CH2:22]1.[Na+:42].[Na+:43].[O-:44][C:45](=[O:46])[O-:47]>>[c:2]1(-[c:27]2[cH:26][c:25]([C:24]([NH:23][CH:20]3[CH2:21][CH2:22]3)=[O:41])[cH:30][cH:29][c:28]2[CH3:31])[cH:3][c:4]2[cH:5][n:6][n:7][c:8]([N:12]3[CH:13]([CH3:19])[C:14](=[O:18])[NH:15][CH2:16][CH2:17]3)[c:9]2[cH:10][cH:11]1

Participants

6

Reactant 5

HCID 923Sodium ion2×HCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 21914577N-cyclopropyl-4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamideHCID 684530974-(6-Bromophthalazin-1-yl)-3-methylpiperazin-2-one

Product 1

HCID 68455992N-cyclopropyl-4-methyl-3-(1-(2-methyl-3-oxopiperazin-1-yl)phthalazin-6-yl)benzamide

Sources & evidence

ORD record
ord-3cd5b3324e2c4e21ba985285cc180f33
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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