Sodium ion → HCID 68455996, compound

HRID 154373Notes

Reaction equation

HRID 154373 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([c:6]([N:10]3[CH2:11][CH2:12][O:13][CH2:14][CH2:15]3)[n:7][n:8][cH:9]2)[n:16][cH:17]1.[CH3:46][O:47][CH2:48][CH2:49][O:50][CH3:51].[CH:18]1([NH:21][C:22]([c:23]2[cH:24][c:25]([B:30]3[O:31][C:32]([CH3:33])([CH3:34])[C:35]([CH3:36])([CH3:37])[O:38]3)[c:26]([CH3:29])[cH:27][cH:28]2)=[O:39])[CH2:19][CH2:20]1.[Na+:40].[Na+:41].[O-:42][C:43](=[O:44])[O-:45]>>[c:2]1(-[c:25]2[cH:24][c:23]([C:22]([NH:21][CH:18]3[CH2:19][CH2:20]3)=[O:39])[cH:28][cH:27][c:26]2[CH3:29])[cH:3][c:4]2[c:5]([c:6]([N:10]3[CH2:11][CH2:12][O:13][CH2:14][CH2:15]3)[n:7][n:8][cH:9]2)[n:16][cH:17]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 684552693-Bromo-8-(4-morpholinyl)pyrido[2,3-d]pyridazine

Product 1

HCID 68455996HCID 68455996, compound

Sources & evidence

ORD record
ord-6c81277cead64531877df2350e796b36
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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