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Cesium carbonate → 1-[(2-Hydroxy-1,2-dimethylpropyl)amino]-7-(pyridin-3-ylethynyl)-5H-pyrido[4,3-b]indole-4-carboxamide

HRID 1971005
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HRID 1971005 반응식
NC1N=[CH:6][C:5]([C:8]2[CH:9]=[CH:10][C:11]3[C:12]4[C:20]([NH:21][CH:22]([CH:26]5[CH2:28][CH2:27]5)[CH:23]5CC5)=[N:19][CH:18]=[C:17]([C:29]([NH2:31])=[O:30])[C:13]=4[NH:14][C:15]=3[CH:16]=2)=CN=1.C([C:34]1[CH:35]=[N:36][CH:37]=[CH:38][CH:39]=1)#C.C(=O)([O-])[O-:41].[Cs+].[Cs+]>CS(C)=O.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.Cl[Pd]Cl>[OH:41][C:26]([CH3:27])([CH3:28])[CH:22]([NH:21][C:20]1[C:12]2[C:11]3[CH:10]=[CH:9][C:8]([C:5]#[C:6][C:34]4[CH:35]=[N:36][CH:37]=[CH:38][CH:39]=4)=[CH:16][C:15]=3[NH:14][C:13]=2[C:17]([C:29]([NH2:31])=[O:30])=[CH:18][N:19]=1)[CH3:23]
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참가 물질

6

반응물 3

HCID 10796Cesium carbonateHCID 1860033-EthynylpyridineHCID 426359017-(2-Aminopyrimidin-5-yl)-1-[(dicyclopropylmethyl)amino]-5H-pyrido[4,3-b]indole-4-carboxamide

생성물 1

HCID 595431631-[(2-Hydroxy-1,2-dimethylpropyl)amino]-7-(pyridin-3-ylethynyl)-5H-pyrido[4,3-b]indole-4-carboxamide

시약·촉매·용매 2

HCID 11050900
Dichlorobis(tricyclohexylphosphine)pallium (II)
촉매
HCID 679Dimethyl Sulfoxide용매

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온도
120 °C

실험 절차

A mixture of 1-[(2-hydroxy-1,2-dimethylpropyl)amino]-7-iodo-5H-pyrido[4,3-b]indole-4-carboxamide (prepared according to Examples 11 and 35, 50 mg, 0.11 mmol), 3-ethynylpyridine (18 mg, 0.17 mmol), cesium carbonate (74 mg, 0.23 mmol), and dichlorobis(tricyclohexylphosphine)palladium(II) (8.4 mg, 0.011 mmol) in DMSO (1.1 mL) was purged with nitrogen for 5 min, heated to 120° C. for 12 h, cooled to room temperature, diluted with EtOAc, and washed with water and brine. The organic layer was dried, concentrated, and purified by flash chromatography to afford the title compound. LRMS (APCI) calc'd for (C24H23N5O2) [M+H]+, 414.2. found 414.1.

후처리

  1. customwas purged with nitrogen for 5 min
  2. temperaturecooled to room temperature
  3. additiondiluted with EtOAc
  4. washwashed with water and brine
  5. customThe organic layer was dried
  6. concentrationconcentrated
  7. custompurified by flash chromatography

출처 및 근거

ORD 기록
ord-b04af4faafd74652952395a5df041756
출처 데이터셋
uspto-grants-2013_04
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08431569B2

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