Isopropanol → (3-amino-1-trityl-1H-indazol-5-yl)(3,5-difluorophenyl)methanone

HRID 1201226Notes

Reaction equation

HRID 1201226 reaction equation
[CH3:55][CH2:56][N:57]([CH2:58][CH3:59])[CH2:60][CH3:61].[CH:51]([OH:52])([CH3:53])[CH3:54].[F:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[c:7]2[cH:8][c:9]3[c:10]([NH:35][C:36](=[O:37])[C:38]([F:39])([F:40])[F:41])[n:11][n:12]([C:16]([c:17]4[cH:18][cH:19][cH:20][cH:21][cH:22]4)([c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[c:29]4[cH:30][cH:31][cH:32][cH:33][cH:34]4)[c:13]3[cH:14][cH:15]2)[cH:42][c:43]([F:45])[cH:44]1.[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1>>[F:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[c:7]2[cH:8][c:9]3[c:10]([NH2:35])[n:11][n:12]([C:16]([c:17]4[cH:18][cH:19][cH:20][cH:21][cH:22]4)([c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[c:29]4[cH:30][cH:31][cH:32][cH:33][cH:34]4)[c:13]3[cH:14][cH:15]2)[cH:42][c:43]([F:45])[cH:44]1

Participants

5

Reactant 4

HCID 3776IsopropanolHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 86647614N-(5-(3,5-Difluorobenzoyl)-1-trityl-1H-indazol-3-yl)-2,2,2-trifluoroacetamide

Product 1

HCID 68670918(3-amino-1-trityl-1H-indazol-5-yl)(3,5-difluorophenyl)methanone

Sources & evidence

ORD record
ord-1576143a0ef649d5971258aa9f13579c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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