Dimethylformamide → N-(6-Methyl-4'-{[2-(4-methylpiperazin-1-ylmethyl)anilino]carbonyl}-1,1'-biphenyl-3-yl)-3-furamide

HRID 1229447

Reaction equation

HRID 1229447 reaction equation
[CH3:25][N:26]1[CH2:27][CH2:28][N:29]([CH2:32][c:33]2[c:34]([NH2:35])[cH:36][cH:37][cH:38][cH:39]2)[CH2:30][CH2:31]1.[CH3:88][CH2:89][O:90][C:91](=[O:92])[CH3:93].[CH:74]([N:75]([CH2:76][CH3:77])[CH:78]([CH3:79])[CH3:80])([CH3:81])[CH3:82].[O:83]=[CH:84][N:85]([CH3:86])[CH3:87].[OH:64][n:65]1[c:66]2[c:67]([cH:68][cH:69][cH:70][cH:71]2)[n:72][n:73]1.[P-:40]([F:41])([F:42])([F:43])([F:44])([F:45])[F:46].[n:47]1([O:48][C:49]([N:50]([CH3:51])[CH3:52])=[N+:53]([CH3:54])[CH3:55])[c:56]2[n:57][cH:58][cH:59][cH:60][c:61]2[n:62][n:63]1.[o:1]1[cH:2][c:3]([C:6](=[O:7])[NH:8][c:9]2[cH:10][cH:11][c:12]([CH3:24])[c:13](-[c:15]3[cH:16][cH:17][c:18]([C:21](=[O:22])[OH:23])[cH:19][cH:20]3)[cH:14]2)[cH:4][cH:5]1>>[o:1]1[cH:2][c:3]([C:6](=[O:7])[NH:8][c:9]2[cH:10][cH:11][c:12]([CH3:24])[c:13](-[c:15]3[cH:16][cH:17][c:18]([C:21](=[O:22])[NH:35][c:34]4[c:33]([CH2:32][N:29]5[CH2:28][CH2:27][N:26]([CH3:25])[CH2:31][CH2:30]5)[cH:39][cH:38][cH:37][cH:36]4)[cH:19][cH:20]3)[cH:14]2)[cH:4][cH:5]1

Participants

9

Reactant 8

HCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 64845562-[(4-Methylpiperazin-1-yl)methyl]anilineHCID 69152146HCID 69152146, compound

Product 1

HCID 69152273N-(6-Methyl-4'-{[2-(4-methylpiperazin-1-ylmethyl)anilino]carbonyl}-1,1'-biphenyl-3-yl)-3-furamide

Sources & evidence

ORD record
ord-6ce40e6e2ddb44ceb7764a3185502879
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Linked notes

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