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

Ammonia → 4-(Amino(5-(4-(bis(4-methoxybenzyl)amino)-6-methyl-1,3,5-triazin-2-YL)-6-(6-methoxypyridin-3-ylamino)pyridin-3-YL)methyl)-N,N-dimethylbenzenesulfonamide

HRID 1621739
Notes
Print preview

Reaction equation

HRID 1621739 reaction equation
CS(O[CH:6]([C:19]1[CH:20]=[N:21][C:22]([NH:51][C:52]2[CH:53]=[N:54][C:55]([O:58][CH3:59])=[CH:56][CH:57]=2)=[C:23]([C:25]2[N:30]=[C:29]([N:31]([CH2:41][C:42]3[CH:47]=[CH:46][C:45]([O:48][CH3:49])=[CH:44][CH:43]=3)[CH2:32][C:33]3[CH:38]=[CH:37][C:36]([O:39][CH3:40])=[CH:35][CH:34]=3)[N:28]=[C:27]([CH3:50])[N:26]=2)[CH:24]=1)[C:7]1[CH:12]=[CH:11][C:10]([S:13](=[O:18])(=[O:17])[N:14]([CH3:16])[CH3:15])=[CH:9][CH:8]=1)(=O)=O.[NH3:60]>C(Cl)Cl.O1CCOCC1>[NH2:60][CH:6]([C:19]1[CH:20]=[N:21][C:22]([NH:51][C:52]2[CH:53]=[N:54][C:55]([O:58][CH3:59])=[CH:56][CH:57]=2)=[C:23]([C:25]2[N:30]=[C:29]([N:31]([CH2:32][C:33]3[CH:34]=[CH:35][C:36]([O:39][CH3:40])=[CH:37][CH:38]=3)[CH2:41][C:42]3[CH:47]=[CH:46][C:45]([O:48][CH3:49])=[CH:44][CH:43]=3)[N:28]=[C:27]([CH3:50])[N:26]=2)[CH:24]=1)[C:7]1[CH:12]=[CH:11][C:10]([S:13]([N:14]([CH3:15])[CH3:16])(=[O:18])=[O:17])=[CH:9][CH:8]=1
ParticipantsConditionsProcedureWorkupSources & evidenceReaction notes

Participants

5

Reactant 2

HCID 222AmmoniaHCID 86647059(5-(4-(bis(4-methoxybenzyl)amino)-6-methyl-1,3,5-triazin-2-yl)-6-(6-methoxypyridin-3-ylamino)pyridin-3-yl)(4-(N,N-dimethylsulfamoyl)phenyl)methyl methanesulfonate

Product 1

HCID 666116764-(Amino(5-(4-(bis(4-methoxybenzyl)amino)-6-methyl-1,3,5-triazin-2-YL)-6-(6-methoxypyridin-3-ylamino)pyridin-3-YL)methyl)-N,N-dimethylbenzenesulfonamide

Reagents, catalysts & solvents 2

HCID 6344
Dichloromethane
Solvent
HCID 312751,4-DioxaneSolvent

Conditions

Temperature
80 °C

Procedure

A solution of (5-(4-(bis(4-methoxybenzyl)amino)-6-methyl-1,3,5-triazin-2-yl)-6-(6-methoxypyridin-3-ylamino)pyridin-3-yl)(4-(N,N-dimethylsulfamoyl)phenyl)methyl methanesulfonate (14.22 mg, 0.017 mmol) in DCM (0.1 mL) was treated with 0.5 M NH3 in dioxane (2 mL). The mixture was allowed to stand overnight, after which time partial conversion to the amine was observed by LCMS. The mixture was then sealed and heated and 80° C. for 2 h, after which time the starting material was consumed. The mixture was concentrated and taken on directly to the next step.

Workup

  1. customThe mixture was then sealed
  2. customafter which time the starting material was consumed
  3. concentrationThe mixture was concentrated

Sources & evidence

ORD record
ord-7b3accae06754d61aac89f030d5ed19c
Source dataset
uspto-grants-2014_07
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US08772480B2

Reaction notes

Loading…

On this pageParticipantsConditionsProcedureWorkupSources & evidenceReaction notes