Bicarbonate Ion → ethyl 2-(6-amino-5-(1-(2,3-difluorophenyl)-1H-tetrazol-5-yl)pyridin-3-yl)-4,5,7,8-tetrahydrothieno[3,2-d]azepine-6-carboxylate

HRID 951197Notes

Reaction equation

HRID 951197 reaction equation
[Br:30][c:31]1[cH:32][c:33]2[c:39]([s:40]1)[CH2:38][CH2:37][N:36]([C:41](=[O:42])[O:43][CH2:44][CH3:45])[CH2:35][CH2:34]2.[CH3:51][N:52]([CH3:53])[CH:54]=[O:55].[CH3:56][CH2:57][O:58][C:59](=[O:60])[CH3:61].[F:1][c:2]1[c:3](-[n:9]2[n:10][n:11][n:12][c:13]2-[c:14]2[c:15]([NH2:29])[n:16][cH:17][c:18]([B:20]3[O:21][C:22]([CH3:23])([CH3:24])[C:25]([CH3:26])([CH3:27])[O:28]3)[cH:19]2)[cH:4][cH:5][cH:6][c:7]1[F:8].[Na+:50].[O-:46][C:47]([OH:48])=[O:49]>>[F:1][c:2]1[c:3](-[n:9]2[n:10][n:11][n:12][c:13]2-[c:14]2[c:15]([NH2:29])[n:16][cH:17][c:18](-[c:31]3[cH:32][c:33]4[c:39]([s:40]3)[CH2:38][CH2:37][N:36]([C:41](=[O:42])[O:43][CH2:44][CH3:45])[CH2:35][CH2:34]4)[cH:19]2)[cH:4][cH:5][cH:6][c:7]1[F:8]

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 57354995Ethyl 2-bromo-4,5,7,8-tetrahydro-6H-thieno[2,3-d]azepine-6-carboxylateHCID 581794573-(1-(2,3-difluorophenyl)-1H-tetrazol-5-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine

Product 1

HCID 58179782ethyl 2-(6-amino-5-(1-(2,3-difluorophenyl)-1H-tetrazol-5-yl)pyridin-3-yl)-4,5,7,8-tetrahydrothieno[3,2-d]azepine-6-carboxylate

Sources & evidence

ORD record
ord-74da5444cb714d549b73299f74cfb5d2
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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