Formamide → 1-(4-methoxyphenyl)-6-(4-{2-[(methylamino)methyl]phenyl}phenyl)-7-oxo-1H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridine-3-carboxamide

HRID 2139718Notes

Reaction equation

HRID 2139718 reaction equation
[CH2:1]([O:3][C:4](=[O:2])[c:6]1[n:7][n:8](-[c:31]2[cH:32][cH:33][c:34]([O:37][CH3:38])[cH:35][cH:36]2)[c:9]2[c:14]1[CH2:13][CH2:12][N:11]([c:15]1[cH:16][cH:17][c:18](-[c:21]3[c:22]([CH2:27][NH:28][CH3:29])[cH:23][cH:24][cH:25][cH:26]3)[cH:19][cH:20]1)[C:10]2=[O:30])[CH3:5].[CH3:48][OH:49].[CH:39](=[O:40])[NH2:41].[O:43]=[CH:44][N:45]([CH3:46])[CH3:47].[OH2:42]>>[O:3]=[C:4]([c:6]1[n:7][n:8](-[c:31]2[cH:32][cH:33][c:34]([O:37][CH3:38])[cH:35][cH:36]2)[c:9]2[c:14]1[CH2:13][CH2:12][N:11]([c:15]1[cH:16][cH:17][c:18](-[c:21]3[c:22]([CH2:27][NH:28][CH3:29])[cH:23][cH:24][cH:25][cH:26]3)[cH:19][cH:20]1)[C:10]2=[O:30])[NH2:41]

Participants

6

Reactant 5

HCID 713FormamideHCID 887MethanolHCID 962WaterHCID 6228DimethylformamideHCID 223185241-(4-Methoxy-phenyl)-6-(2'-methylaminomethyl-biphenyl-4-yl)-7-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c)pyridine-3-carboxylic acid ethyl ester

Product 1

HCID 101167521-(4-methoxyphenyl)-6-(4-{2-[(methylamino)methyl]phenyl}phenyl)-7-oxo-1H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridine-3-carboxamide

Sources & evidence

ORD record
ord-0468d7916b064d39b716f1b1226d7064
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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