Methanol → (3-Ethynyl-pyrrolidin-1-yl)-[1-(6,7,8,9-tetrahydro-5H-1,4,7,10a-tetraaza-cyclohepta[f]inden-10-yl)-azetidin-3-yl]-methanone

HRID 528778ノート

反応式

HRID 528778 の反応式
C(OC([N:8]1[CH2:34][CH2:33][C:12]2=[C:13]([N:20]3[CH2:23][CH:22]([C:24]([N:26]4[CH2:30][CH2:29][CH:28]([C:31]#[CH:32])[CH2:27]4)=[O:25])[CH2:21]3)[N:14]3[C:18]([N:19]=[C:11]2[CH2:10][CH2:9]1)=[CH:17][CH:16]=[N:15]3)=O)(C)(C)C.C(O)(C(F)(F)F)=O.CO>C(Cl)Cl>[C:31]([CH:28]1[CH2:29][CH2:30][N:26]([C:24]([CH:22]2[CH2:21][N:20]([C:13]3[N:14]4[C:18]([N:19]=[C:11]5[CH2:10][CH2:9][NH:8][CH2:34][CH2:33][C:12]=35)=[CH:17][CH:16]=[N:15]4)[CH2:23]2)=[O:25])[CH2:27]1)#[CH:32]

参加物

5

反応物 3

HCID 887MethanolHCID 6422Trifluoroacetic acidHCID 8666717710-[3-(3-Ethynyl-pyrrolidine-1-carbonyl)-azetidin-1-yl]-5,6,8,9-tetrahydro-1,4,7,10a-tetraaza-cyclohept[f]indene-7-carboxylic acid tert-butyl ester

生成物 1

HCID 86667178(3-Ethynyl-pyrrolidin-1-yl)-[1-(6,7,8,9-tetrahydro-5H-1,4,7,10a-tetraaza-cyclohepta[f]inden-10-yl)-azetidin-3-yl]-methanone

試薬・触媒・溶媒 1

HCID 6344Dichloromethane溶媒

実験手順

To 36 mg (0.08 mmol) 10-[3-(3-Ethynyl-pyrrolidine-1-carbonyl)-azetidin-1-yl]-5,6,8,9-tetrahydro-1,4,7,10a-tetraaza-cyclohept[f]indene-7-carboxylic acid tert-butyl ester in 10 mL DCM was added 0.4 mL TFA and stirring was continued for 3 h at room temperature. After addition of 2 mL of MeOH 2M NaOH added drop wise to neutralize the reaction mixture. The solvents were evaporated and the residue was purified by HPLC.

後処理

  1. customThe solvents were evaporated
  2. customthe residue was purified by HPLC

出典と根拠

ORDレコード
ord-a5b2761bf08f4bd2baff370e40231e0b
出典データセット
uspto-grants-2016_05
特許番号
US09346816B2

反応ノート

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