Dimethylformamide → HCID 178472597, compound

HRID 677956Notes

Reaction equation

HRID 677956 reaction equation
[B-:54]([F:55])([F:56])([F:57])[F:58].[CH3:76][CH2:77][N:78]([CH2:79][CH3:80])[CH2:81][CH3:82].[N:1]1([CH2:13][C:14](=[O:15])[O:16][CH2:17][CH3:18])[CH2:2][CH2:3][CH:4]([CH:7]2[CH2:8][CH2:9][NH:10][CH2:11][CH2:12]2)[CH2:5][CH2:6]1.[O:19]=[C:20]1[NH:21][c:22]2[c:23]([cH:50][cH:51][cH:52][cH:53]2)[CH2:24][CH2:25][N:26]1[CH:27]1[CH2:28][CH2:29][N:30]([C:33](=[O:34])[O:35][CH:36]([CH2:37][c:38]2[cH:39][c:40]([Br:46])[c:41]([OH:45])[c:42]([Br:44])[cH:43]2)[C:47](=[O:48])[OH:49])[CH2:31][CH2:32]1.[O:83]=[CH:84][N:85]([CH3:86])[CH3:87].[n:59]1([O:60][C:61]([N:62]([CH3:63])[CH3:64])=[N+:65]([CH3:66])[CH3:67])[c:68]2[cH:69][cH:70][cH:71][cH:72][c:73]2[n:74][n:75]1>>[N:1]1([CH2:13][C:14](=[O:15])[O:16][CH2:17][CH3:18])[CH2:2][CH2:3][CH:4]([CH:7]2[CH2:8][CH2:9][N:10]([C:47]([CH:36]([O:35][C:33]([N:30]3[CH2:29][CH2:28][CH:27]([N:26]4[C:20](=[O:19])[NH:21][c:22]5[c:23]([cH:50][cH:51][cH:52][cH:53]5)[CH2:24][CH2:25]4)[CH2:32][CH2:31]3)=[O:34])[CH2:37][c:38]3[cH:39][c:40]([Br:46])[c:41]([OH:45])[c:42]([Br:44])[cH:43]3)=[O:48])[CH2:11][CH2:12]2)[CH2:5][CH2:6]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 8471TriethylamineHCID 26255TetrafluoroborateHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 22945803Ethyl [4,4′-bipiperidine]-1-acetateHCID 673018823-(3,5-dibromo-4-hydroxyphenyl)-2-[4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidine-1-carbonyl]oxypropanoic acid

Product 1

HCID 178472597HCID 178472597, compound

Sources & evidence

ORD record
ord-6e78ff9ce4c44926bac43ad6156a2f6a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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