Dimethylformamide → HCID 178469846, compound

HRID 313459Notes

Reaction equation

HRID 313459 reaction equation
[B-:64]([F:65])([F:66])([F:67])[F:68].[CH2:46]([CH3:47])[O:48][C:49](=[O:50])[CH:51]1[N:52]([CH:57]2[CH2:58][CH2:59][N:60]([CH3:63])[CH2:61][CH2:62]2)[CH2:53][CH2:54][NH:55][CH2:56]1.[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[O:86]=[CH:87][N:88]([CH3:89])[CH3:90].[O:8]=[C:9]1[NH:10][c:11]2[c:12]([cH:42][cH:43][cH:44][cH:45]2)[CH2:13][CH2:14][N:15]1[CH:16]1[CH2:17][CH2:18][N:19]([C:22](=[O:23])[O:24][CH:25]([CH2:26][c:27]2[cH:28][c:29]([Cl:38])[c:30]([NH2:37])[c:31]([C:33]([F:34])([F:35])[F:36])[cH:32]2)[C:39](=[O:40])[OH:41])[CH2:20][CH2:21]1.[n:69]1([O:70][C:71]([N:72]([CH3:73])[CH3:74])=[N+:75]([CH3:76])[CH3:77])[c:78]2[cH:79][cH:80][cH:81][cH:82][c:83]2[n:84][n:85]1>>[O:8]=[C:9]1[NH:10][c:11]2[c:12]([cH:42][cH:43][cH:44][cH:45]2)[CH2:13][CH2:14][N:15]1[CH:16]1[CH2:17][CH2:18][N:19]([C:22](=[O:23])[O:24][CH:25]([CH2:26][c:27]2[cH:28][c:29]([Cl:38])[c:30]([NH2:37])[c:31]([C:33]([F:34])([F:35])[F:36])[cH:32]2)[C:39](=[O:40])[N:55]2[CH2:54][CH2:53][N:52]([CH:57]3[CH2:58][CH2:59][N:60]([CH3:63])[CH2:61][CH2:62]3)[CH:51]([C:49]([O:48][CH2:46][CH3:47])=[O:50])[CH2:56]2)[CH2:20][CH2:21]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 8471TriethylamineHCID 26255TetrafluoroborateHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 57848511HCID 57848511, compoundHCID 669418853-[4-amino-3-chloro-5-(trifluoromethyl)phenyl]-2-[4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidine-1-carbonyl]oxypropanoic acid

Product 1

HCID 178469846HCID 178469846, compound

Sources & evidence

ORD record
ord-242c0407453e4030a1dc3542e63c9cab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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