Bromide ion → Bromide ion

HRID 2314156Notes

Reaction equation

HRID 2314156 reaction equation
[Br-:1].[CH2:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[O:30][c:31]1[cH:32][cH:33][c:34]([CH2:37][C:38](=[O:39])[OH:40])[cH:35][cH:36]1.[CH3:41][N:42]1[CH2:43][CH2:44][O:45][CH2:46][CH2:47]1.[CH:48]1([N:49]=[C:50]=[N:51][CH:52]2[CH2:53][CH2:54][CH2:55][CH2:56][CH2:57]2)[CH2:58][CH2:59][CH2:60][CH2:61][CH2:62]1.[NH2:2][CH2:3][CH2:4][CH2:5][N+:6]([CH3:7])([CH3:8])[CH2:9][CH2:10][NH:11][C:12](=[O:13])[c:14]1[n:15][c:16]([Cl:22])[c:17]([NH2:21])[n:18][c:19]1[NH2:20].[O:73]=[CH:74][N:75]([CH3:76])[CH3:77].[OH:63][n:64]1[c:65]2[cH:66][cH:67][cH:68][cH:69][c:70]2[n:71][n:72]1>>[Br-:1].[NH:2]([CH2:3][CH2:4][CH2:5][N+:6]([CH3:7])([CH3:8])[CH2:9][CH2:10][NH:11][C:12](=[O:13])[c:14]1[n:15][c:16]([Cl:22])[c:17]([NH2:21])[n:18][c:19]1[NH2:20])[C:38]([CH2:37][c:34]1[cH:33][cH:32][c:31]([O:30][CH2:23][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[cH:36][cH:35]1)=[O:39]

Participants

9

Reactant 7

HCID 259Bromide ionHCID 6228DimethylformamideHCID 79724-MethylmorpholineHCID 10868DicyclohexylcarbodiimideHCID 757711-HydroxybenzotriazoleHCID 810334-Benzyloxyphenylacetic acidHCID 86656638HCID 86656638, compound

Product 2

HCID 259Bromide ionHCID 445469422-[(3,5-Diamino-6-chloropyrazine-2-carbonyl)amino]ethyl-dimethyl-[3-[[2-(4-phenylmethoxyphenyl)acetyl]amino]propyl]azanium

Sources & evidence

ORD record
ord-74fdf4be88ab4809ab1a86fc336fa4a7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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