Potassium Cation → 2-(1-(2-(2,4-Difluorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl)-1H-indazol-5-ylamino)-N-(2,6-dimethylphenyl)acetamide

HRID 103786

Reaction equation

HRID 103786 reaction equation
[Br:34][CH2:35][C:36](=[O:37])[NH:38][c:39]1[c:40]([CH3:46])[cH:41][cH:42][cH:43][c:44]1[CH3:45].[C:28](=[O:29])([O-:30])[O-:31].[K+:32].[K+:33].[NH2:1][c:2]1[cH:3][c:4]2[cH:5][n:6][n:7]([CH2:11][C:12]([CH2:13][n:14]3[n:15][cH:16][n:17][cH:18]3)([OH:19])[c:20]3[c:21]([F:27])[cH:22][c:23]([F:26])[cH:24][cH:25]3)[c:8]2[cH:9][cH:10]1>>[NH:1]([c:2]1[cH:3][c:4]2[cH:5][n:6][n:7]([CH2:11][C:12]([CH2:13][n:14]3[n:15][cH:16][n:17][cH:18]3)([OH:19])[c:20]3[c:21]([F:27])[cH:22][c:23]([F:26])[cH:24][cH:25]3)[c:8]2[cH:9][cH:10]1)[CH2:35][C:36](=[O:37])[NH:38][c:39]1[c:40]([CH3:46])[cH:41][cH:42][cH:43][c:44]1[CH3:45]

Participants

5

Reactant 4

HCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 27634872-bromo-N-(2,6-dimethylphenyl)acetamideHCID 68644438(5-Amino-1H-indazol-1-yl)-2-(2,4-difluorophenyl)-3-(1H-1,2,4-triazol-1-yl)propan-2-ol

Product 1

HCID 686449082-(1-(2-(2,4-Difluorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl)-1H-indazol-5-ylamino)-N-(2,6-dimethylphenyl)acetamide

Sources & evidence

ORD record
ord-e7ae2452715f4947a418ffe81fa0ccea
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

Loading…