HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Reaction

Ethanol → 7-Methyl-6-[4-(trifluoromethyl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one

HRID 826914
Notes
Print preview

Reaction equation

HRID 826914 reaction equation
[CH3:1][c:2]1[n:3][c:4]2[n:5]([c:6](=[O:16])[c:7]1-[c:8]1[cH:9][cH:10][c:11]([C:12]#[N:13])[cH:14][cH:15]1)[cH:17][cH:18][s:19]2.[CH3:58][c:59]1[cH:60][cH:61][cH:62][cH:63][cH:64]1.[CH3:66][CH2:67][OH:68].[F:20][C:21]([c:22]1[cH:23][cH:24][c:25]([B:28]([OH:29])[OH:30])[cH:26][cH:27]1)([F:31])[F:32].[F:39][c:40]1[cH:41][c:42](-[c:43]2[c:44](=[O:45])[n:46]3[cH:47][cH:48][s:49][c:50]3[n:51][c:52]2[CH3:53])[cH:54][c:55]([F:56])[cH:57]1.[Na+:33].[Na+:34].[O-:35][C:36](=[O:37])[O-:38].[OH2:65]>>[CH3:1][c:2]1[n:3][c:4]2[n:5]([c:6](=[O:16])[c:7]1-[c:25]1[cH:24][cH:23][c:22]([C:21]([F:20])([F:31])[F:32])[cH:27][cH:26]1)[cH:17][cH:18][s:19]2
ParticipantsSources & evidenceReaction notes

Participants

9

Reactant 8

HCID 702EthanolHCID 923Sodium Ion2×HCID 962WaterHCID 1140TolueneHCID 19660Carbonate IonHCID 27343894-(Trifluoromethyl)phenylboronic acidHCID 66752927HCID 66752927, compound
HCID 66753471
6-(3,5-Difluorophenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one

Product 1

HCID 667528027-Methyl-6-[4-(trifluoromethyl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one

Sources & evidence

ORD record
ord-ee169734517b4be8b417e28024038329
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

Reaction notes

Loading…

On this pageParticipantsSources & evidenceReaction notes