Potassium Cation → N-(3,4-dichlorophenyl)-4-[3-(8-hydroxy-6-azaspiro[2.5]octan-6-yl)-3-oxopropyl]-2-methyl-3-oxopiperazine-1-carboxamide

HRID 190046Notes

Reaction equation

HRID 190046 reaction equation
[CH2:25]1[CH2:26][C:27]12[CH:28]([OH:33])[CH2:29][NH:30][CH2:31][CH2:32]2.[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[CH3:76][CH2:77][CH2:78][CH2:79][CH2:80][CH2:81][CH3:82].[Cl:1][c:2]1[cH:3][c:4]([NH:9][C:10](=[O:11])[N:12]2[CH:13]([CH3:24])[C:14](=[O:23])[N:15]([CH2:18][CH2:19][C:20](=[O:21])[OH:22])[CH2:16][CH2:17]2)[cH:5][cH:6][c:7]1[Cl:8].[K+:70].[O:71]=[CH:72][N:73]([CH3:74])[CH3:75].[P-:41]([F:42])([F:43])([F:44])([F:45])([F:46])[F:47].[S:65](=[O:66])(=[O:67])([OH:68])[O-:69].[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>>[Cl:1][c:2]1[cH:3][c:4]([NH:9][C:10](=[O:11])[N:12]2[CH:13]([CH3:24])[C:14](=[O:23])[N:15]([CH2:18][CH2:19][C:20](=[O:22])[N:30]3[CH2:29][CH:28]([OH:33])[C:27]4([CH2:25][CH2:26]4)[CH2:32][CH2:31]3)[CH2:16][CH2:17]2)[cH:5][cH:6][c:7]1[Cl:8]

Participants

10

Reactant 9

HCID 813Potassium CationHCID 6228DimethylformamideHCID 8471TriethylamineHCID 8900HeptaneHCID 9886HexafluorophosphateHCID 61778Sulfate, hydrogenHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 667827006-Azaspiro[2.5]octan-4-olHCID 670749783-[4-[(3,4-Dichlorophenyl)carbamoyl]-3-methyl-2-oxopiperazin-1-yl]propanoic acid

Product 1

HCID 77223854N-(3,4-dichlorophenyl)-4-[3-(8-hydroxy-6-azaspiro[2.5]octan-6-yl)-3-oxopropyl]-2-methyl-3-oxopiperazine-1-carboxamide

Sources & evidence

ORD record
ord-548ae3421b5c448f9bdd60cf32c34eb5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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