Hydrochloric Acid → 4-(4-Chloro-2-methanesulfonyl-benzyl)-piperazine-1-carboxylic acid (7-methoxy-thiazolo[5,4-d]pyrimidin-2-yl)-amide

HRID 692926Notes

Reaction equation

HRID 692926 reaction equation
[Br:31][CH2:32][c:33]1[c:34]([S:40](=[O:41])(=[O:42])[CH3:43])[cH:35][c:36]([Cl:39])[cH:37][cH:38]1.[CH3:2][O:3][c:4]1[c:5]2[c:6]([n:7][cH:8][n:9]1)[s:10][c:11]([NH:13][C:14](=[O:15])[N:16]1[CH2:17][CH2:18][NH:19][CH2:20][CH2:21]1)[n:12]2.[CH3:45][N:46]([CH3:47])[CH:48]=[O:49].[CH:22]([N:23]([CH2:24][CH3:25])[CH:26]([CH3:27])[CH3:28])([CH3:29])[CH3:30].[ClH:1].[OH2:44]>>[CH3:2][O:3][c:4]1[c:5]2[c:6]([n:7][cH:8][n:9]1)[s:10][c:11]([NH:13][C:14](=[O:15])[N:16]1[CH2:17][CH2:18][N:19]([CH2:32][c:33]3[c:34]([S:40](=[O:41])(=[O:42])[CH3:43])[cH:35][c:36]([Cl:39])[cH:37][cH:38]3)[CH2:20][CH2:21]1)[n:12]2

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 962WaterHCID 6228DimethylformamideHCID 81531DiisopropylethylamineHCID 27610541-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzeneHCID 59011970N-(7-methoxy-[1,3]thiazolo[5,4-d]pyrimidin-2-yl)piperazine-1-carboxamide

Product 1

HCID 248317194-(4-Chloro-2-methanesulfonyl-benzyl)-piperazine-1-carboxylic acid (7-methoxy-thiazolo[5,4-d]pyrimidin-2-yl)-amide

Sources & evidence

ORD record
ord-86adaa4ef5994ceeb5be6b6323e6a879
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…