Dichloromethane → N-(5-(4-acetylpiperazin-1-yl)pyridin-2-yl)-2-(6-chloro-5-fluoropyridin-3-yl)acetamide

HRID 182766Notes

Reaction equation

HRID 182766 reaction equation
[CH:40]([N:41]([CH2:42][CH3:43])[CH:44]([CH3:45])[CH3:46])([CH3:47])[CH3:48].[Cl:1][c:2]1[c:3]([F:16])[cH:4][c:5]([CH2:8][C:9]([O:11][C:10]([CH3:12])([CH3:13])[CH3:14])=[O:15])[cH:6][n:7]1.[Cl:73][CH2:74][Cl:75].[F:17][C:18]([F:19])([F:20])[C:21]([OH:22])=[O:23].[NH2:24][c:25]1[cH:26][cH:27][c:28]([N:31]2[CH2:32][CH2:33][N:34]([C:37]([CH3:38])=[O:39])[CH2:35][CH2:36]2)[cH:29][n:30]1.[P-:49]([F:50])([F:51])([F:52])([F:53])([F:54])[F:55].[n:56]1([O:57][C:58]([N:59]([CH3:60])[CH3:61])=[N+:62]([CH3:63])[CH3:64])[c:65]2[n:66][cH:67][cH:68][cH:69][c:70]2[n:71][n:72]1>>[Cl:1][c:2]1[c:3]([F:16])[cH:4][c:5]([CH2:8][C:9](=[O:11])[NH:24][c:25]2[cH:26][cH:27][c:28]([N:31]3[CH2:32][CH2:33][N:34]([C:37]([CH3:38])=[O:39])[CH2:35][CH2:36]3)[cH:29][n:30]2)[cH:6][n:7]1

Participants

8

Reactant 7

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 284116891-(4-(6-Aminopyridin-3-YL)piperazin-1-YL)ethan-1-oneHCID 58365072Tert-butyl 2-(6-chloro-5-fluoropyridin-3-yl)acetate

Product 1

HCID 58447659N-(5-(4-acetylpiperazin-1-yl)pyridin-2-yl)-2-(6-chloro-5-fluoropyridin-3-yl)acetamide

Sources & evidence

ORD record
ord-46a33cf5d2634e03bf91cfd8c7982770
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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