Potassium Cation → N-(1-azabicyclo[2.2.2]oct-3-yl)-2-(4-ethynylphenyl)benzoxazole-4-carboxamide

HRID 94075Notes

Reaction equation

HRID 94075 reaction equation
[C:33](=[O:34])([O-:35])[O-:36].[CH3:39][OH:40].[CH3:41][CH2:42][O:43][C:44](=[O:45])[CH3:46].[K+:37].[K+:38].[N:1]12[CH2:2][CH:3]([NH:9][C:10](=[O:11])[c:12]3[cH:13][cH:14][cH:15][c:16]4[c:17]3[n:18][c:19](-[c:21]3[cH:22][cH:23][c:24]([C:27]#[C:28][Si:29]([CH3:30])([CH3:31])[CH3:32])[cH:25][cH:26]3)[o:20]4)[CH:4]([CH2:5][CH2:6]1)[CH2:7][CH2:8]2>>[N:1]12[CH2:2][CH:3]([NH:9][C:10](=[O:11])[c:12]3[cH:13][cH:14][cH:15][c:16]4[c:17]3[n:18][c:19](-[c:21]3[cH:22][cH:23][c:24]([C:27]#[CH:28])[cH:25][cH:26]3)[o:20]4)[CH:4]([CH2:5][CH2:6]1)[CH2:7][CH2:8]2

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 887MethanolHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 11525069N-(1-azabicyclo[2.2.2]oct-3-yl)-2-(4-trimethylsilylethynylphenyl)benzoxazole-4-carboxamide

Product 1

HCID 11537988N-(1-azabicyclo[2.2.2]oct-3-yl)-2-(4-ethynylphenyl)benzoxazole-4-carboxamide

Sources & evidence

ORD record
ord-b9d1be9e774a47ceb3902defa593db03
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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