Hydrogen Bromide → {1-[6-(6-Bromo-1H-benzoimidazol-2-yl)-5-aza-spiro[2.4]heptane-5-carbonyl]-2-methyl-propyl]-carbamic acid methyl ester

HRID 1222443Notes

Reaction equation

HRID 1222443 reaction equation
[BrH:28].[CH2:1]([O:2][C:3](=[O:4])[N:11]1[CH2:12][C:13]2([CH2:14][CH2:15]2)[CH2:16][CH:17]1[c:18]1[n:19][c:20]2[c:21]([nH:22]1)[cH:23][c:24]([Br:27])[cH:25][cH:26]2)[c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1.[CH3:29][O:30][C:31](=[O:32])[NH:33][CH:34]([C:35](=[O:36])[OH:37])[CH:38]([CH3:39])[CH3:40].[CH3:77][CH2:78][O:79][C:80]([CH3:81])=[O:82].[CH:65]([N:66]([CH2:67][CH3:68])[CH:69]([CH3:70])[CH3:71])([CH3:72])[CH3:73].[Cl:74][CH2:75][Cl:76].[O:83]=[CH:84][N:85]([CH3:86])[CH3:87].[P-:41]([F:42])([F:43])([F:44])([F:45])([F:46])[F:47].[n:48]1([O:49][C:50]([N:51]([CH3:52])[CH3:53])=[N+:54]([CH3:55])[CH3:56])[c:57]2[n:58][cH:59][cH:60][cH:61][c:62]2[n:63][n:64]1>>[N:11]1([C:35]([CH:34]([NH:33][C:31]([O:30][CH3:29])=[O:32])[CH:38]([CH3:39])[CH3:40])=[O:36])[CH2:12][C:13]2([CH2:14][CH2:15]2)[CH2:16][CH:17]1[c:18]1[n:19][c:20]2[c:21]([nH:22]1)[cH:23][c:24]([Br:27])[cH:25][cH:26]2

Participants

10

Reactant 9

HCID 260Hydrogen BromideHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 138211012-((Methoxycarbonyl)amino)-3-methylbutanoic acidHCID 666203746-(6-Bromo-1H-benzoimidazol-2-yl)-5-aza-spiro[2.4]heptane-5-carboxylic acid benzyl ester

Product 1

HCID 66621073{1-[6-(6-Bromo-1H-benzoimidazol-2-yl)-5-aza-spiro[2.4]heptane-5-carbonyl]-2-methyl-propyl]-carbamic acid methyl ester

Sources & evidence

ORD record
ord-f22f24145ccb4035a79d9cc4ff9e960d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…