Pyridine-4-carbonyl chloride → HCID 44548796, compound

HRID 707132Notes

Reaction equation

HRID 707132 reaction equation
OC(C(F)(F)F)=O.OC(C(F)(F)F)=O.[CH:15]12[O:22][CH:19]([CH2:20][CH2:21]1)[CH2:18][N:17]([C:23]1[N:28]=[C:27]([N:29]3[CH2:34][CH2:33][NH:32][CH2:31][CH2:30]3)[N:26]=[C:25]([C:35]3[CH:40]=[CH:39][C:38]([NH:41][C:42]([NH:44][C:45]4[CH:50]=[CH:49][N:48]=[CH:47][CH:46]=4)=[O:43])=[CH:37][CH:36]=3)[N:24]=1)[CH2:16]2.[C:51](Cl)(=[O:58])[C:52]1[CH:57]=[CH:56][N:55]=[CH:54][CH:53]=1>ClCCl.C(N(CC)CC)C>[C:51]([N:32]1[CH2:33][CH2:34][N:29]([C:27]2[N:28]=[C:23]([N:17]3[CH2:16][CH:15]4[O:22][CH:19]([CH2:20][CH2:21]4)[CH2:18]3)[N:24]=[C:25]([C:35]3[CH:36]=[CH:37][C:38]([NH:41][C:42]([NH:44][C:45]4[CH:46]=[CH:47][N:48]=[CH:49][CH:50]=4)=[O:43])=[CH:39][CH:40]=3)[N:26]=2)[CH2:30][CH2:31]1)(=[O:58])[C:52]1[CH:57]=[CH:56][N:55]=[CH:54][CH:53]=1

Participants

5

Reactant 2

HCID 417436Pyridine-4-carbonyl chlorideHCID 130403997HCID 130403997, compound

Product 1

HCID 44548796HCID 44548796, compound

Reagents, catalysts & solvents 2

HCID 6344DichloromethaneSolventHCID 8471TriethylamineSolvent

Procedure

1-(4-(4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-6-(piperazin-1-yl)-1,3,5-triazin-2-yl)phenyl)-3-(pyridin-4-yl)urea-2TFA (100 mg) in dichloromethane (4 mL) and triethylamine (1 mL) was treated with isonicotinoyl chloride (100 mg). The mixture was concentrated to dryness and purified on HPLC to give the title compound as its di-TFA salt; MS (ES+) 593.1 (M+H)+

Workup

  1. concentrationThe mixture was concentrated to dryness
  2. custompurified on HPLC

Sources & evidence

ORD record
ord-8240d36227c243aab452643419085717
Source dataset
uspto-grants-2015_11
Patent number
US09174963B2

Reaction notes

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