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llms.txt · MCPガイドプライバシーポリシー · 利用規約 · サポートv1.8.0
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1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide → Tert-butyl 4-(6-(5-(3-fluoro-2-(2-hydroxy-2-phenylpentylcarbamoyl)pyridin-4-ylthio)thiazol-2-ylamino)pyridin-3-ylamino)piperidine-1-carboxylate

HRID 1685353
ノート
印刷プレビュー

反応式

HRID 1685353 の反応式
[C:1]([O:5][C:6]([N:8]1[CH2:13][CH2:12][CH:11]([NH:14][C:15]2[CH:16]=[CH:17][C:18]([NH:21][C:22]3[S:23][C:24]([S:27][C:28]4[CH:33]=[CH:32][N:31]=[C:30]([C:34](O)=[O:35])[C:29]=4[F:37])=[CH:25][N:26]=3)=[N:19][CH:20]=2)[CH2:10][CH2:9]1)=[O:7])([CH3:4])([CH3:3])[CH3:2].[NH2:38][CH2:39][C:40]([C:45]1[CH:50]=[CH:49][CH:48]=[CH:47][CH:46]=1)([OH:44])[CH2:41][CH2:42][CH3:43].CCN=C=NCCCN(C)C.C1C=CC2N(O)N=NC=2C=1.CCN(C(C)C)C(C)C>CN1C(=O)CCC1.O>[F:37][C:29]1[C:30]([C:34](=[O:35])[NH:38][CH2:39][C:40]([OH:44])([C:45]2[CH:46]=[CH:47][CH:48]=[CH:49][CH:50]=2)[CH2:41][CH2:42][CH3:43])=[N:31][CH:32]=[CH:33][C:28]=1[S:27][C:24]1[S:23][C:22]([NH:21][C:18]2[N:19]=[CH:20][C:15]([NH:14][CH:11]3[CH2:12][CH2:13][N:8]([C:6]([O:5][C:1]([CH3:2])([CH3:3])[CH3:4])=[O:7])[CH2:9][CH2:10]3)=[CH:16][CH:17]=2)=[N:26][CH:25]=1
参加物実験手順後処理出典と根拠反応ノート

参加物

8

反応物 5

HCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 229923231-Amino-2-phenylpentan-2-olHCID 592004754-(2-(5-(1-(Tert-butoxycarbonyl)piperidin-4-ylamino)pyridin-2-ylamino)thiazol-5-ylthio)-3-fluoropicolinic acid

生成物 1

HCID 59200444
Tert-butyl 4-(6-(5-(3-fluoro-2-(2-hydroxy-2-phenylpentylcarbamoyl)pyridin-4-ylthio)thiazol-2-ylamino)pyridin-3-ylamino)piperidine-1-carboxylate

試薬・触媒・溶媒 2

HCID 962Water溶媒HCID 13387N-methyl-2-pyrrolidone溶媒

実験手順

To a stirring solution of 4-(2-(5-(1-(tert-butoxycarbonyl)piperidin-4-ylamino)pyridin-2-ylamino)thiazol-5-ylthio)-3-fluoropicolinic acid (586 mg, 1.072 mmol), 1-amino-2-phenylpentan-2-ol (479 mg, 2.672 mmol), EDAC (621 mg, 3.239 mmol), HOBt (235 mg, 1.739 mmol) in NMP (7 mL) was added i-Pr2NEt (0.93 mL, 5.339 mmol) and stirred overnight. LCMS showed complete reaction, which was poured into ˜50 mL water and a solid precipitated. The solid was collected by filtration, washed with water and was allowed to air dry. The product was obtained (838 mg, 100%) as a solid: LC/MS (M+H)+: 708. HPLC ret. time (Condition M): 1.95 min.

後処理

  1. customreaction, which
  2. customa solid precipitated
  3. filtrationThe solid was collected by filtration
  4. washwashed with water
  5. customto air dry
  6. customThe product was obtained (838 mg, 100%) as a solid
  7. custom1.95 min.

出典と根拠

ORDレコード
ord-8b431d7e4269476895e4166d6104d56f
出典データセット
uspto-grants-2012_04
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08148400B2

反応ノート

読み込み中…

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