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Hydrochloric Acid → 1-{2-[{6-[{4-[{3-[({[(2S)-1'-{2-[(5R)-3-[3,5-Bis(trifluoromethyl)benzoyl]-5-(4-fluorophenyl)-1,3-oxazolidin-5-yl]ethyl}-2,3-dihydrospiro[indene-1,4'-piperidin]-2-yl]oxy}acetyl)(methy)amino]propyl}(methyl)carbamoyl]benzyl}(methyl)amino]hexanoyl}(methyl)amino]ethyl}piperidin-4-yl biphenyl-2-ylcarbamate

HRID 446568
ノート
印刷プレビュー

反応式

HRID 446568 の反応式
[C:1]1([C:41]2[CH:46]=[CH:45][CH:44]=[CH:43][CH:42]=2)[CH:6]=[CH:5][CH:4]=[CH:3][C:2]=1[NH:7][C:8]([O:10][CH:11]1[CH2:16][CH2:15][N:14]([CH2:17][CH2:18][N:19]([CH3:40])[C:20](=[O:39])[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][N:26]([CH2:28][C:29]2[CH:38]=[CH:37][C:32](C(OC)=O)=[CH:31][CH:30]=2)[CH3:27])[CH2:13][CH2:12]1)=[O:9].[OH-:47].[Na+].Cl.[F:50][C:51]([F:104])([F:103])[C:52]1[CH:53]=[C:54]([CH:96]=[C:97]([C:99]([F:102])([F:101])[F:100])[CH:98]=1)[C:55]([N:57]1[CH2:61][C@@:60]([CH2:69][CH2:70][N:71]2[CH2:76][CH2:75][C:74]3([C:84]4[C:79](=[CH:80][CH:81]=[CH:82][CH:83]=4)[CH2:78][C@@H:77]3[O:85][CH2:86][C:87]([N:89]([CH3:95])[CH2:90][CH2:91][CH2:92][NH:93][CH3:94])=[O:88])[CH2:73][CH2:72]2)([C:62]2[CH:67]=[CH:66][C:65]([F:68])=[CH:64][CH:63]=2)[O:59][CH2:58]1)=[O:56].[CH3:105]O>O.C1(C)C=CC=CC=1>[C:1]1([C:41]2[CH:42]=[CH:43][CH:44]=[CH:45][CH:46]=2)[CH:6]=[CH:5][CH:4]=[CH:3][C:2]=1[NH:7][C:8](=[O:9])[O:10][CH:11]1[CH2:12][CH2:13][N:14]([CH2:17][CH2:18][N:19]([C:20](=[O:39])[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][N:26]([CH2:28][C:29]2[CH:38]=[CH:37][C:32]([C:94](=[O:47])[N:93]([CH2:92][CH2:91][CH2:90][N:89]([C:87](=[O:88])[CH2:86][O:85][C@@H:77]3[C:74]4([CH2:73][CH2:72][N:71]([CH2:70][CH2:69][C@:60]5([C:62]6[CH:63]=[CH:64][C:65]([F:68])=[CH:66][CH:67]=6)[O:59][CH2:58][N:57]([C:55](=[O:56])[C:54]6[CH:53]=[C:52]([C:51]([F:50])([F:103])[F:104])[CH:98]=[C:97]([C:99]([F:101])([F:100])[F:102])[CH:96]=6)[CH2:61]5)[CH2:76][CH2:75]4)[C:84]4[C:79](=[CH:80][CH:81]=[CH:82][CH:83]=4)[CH2:78]3)[CH3:95])[CH3:105])=[CH:31][CH:30]=2)[CH3:27])[CH3:40])[CH2:15][CH2:16]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 313Hydrochloric AcidHCID 887MethanolHCID 14798Sodium HydroxideHCID 66671734Methyl 4-{[{6-[(2-{4-[(biphenyl-2-ylcarbamoyl)oxy]piperidin-1-yl}ethyl)(methyl)amino]-6-oxohexyl}(methyl)amino]methyl}benzoateHCID 866634192-{[(2S)-1'-{2-[(5R)-3-[3,5-Bis(trifluoromethyl)benzoyl]-5-(4-fluorophenyl)-1,3-oxazolidin-5-yl]ethyl}-2,3-dihydrospiro[indene-1,4'-piperidin]-2-yl]oxy}-N-methyl-N-[3-(methylamino)propyl]acetamide

生成物 1

HCID 469286381-{2-[{6-[{4-[{3-[({[(2S)-1'-{2-[(5R)-3-[3,5-Bis(trifluoromethyl)benzoyl]-5-(4-fluorophenyl)-1,3-oxazolidin-5-yl]ethyl}-2,3-dihydrospiro[indene-1,4'-piperidin]-2-yl]oxy}acetyl)(methy)amino]propyl}(methyl)carbamoyl]benzyl}(methyl)amino]hexanoyl}(methyl)amino]ethyl}piperidin-4-yl biphenyl-2-ylcarbamate収率 48%

試薬・触媒・溶媒 2

HCID 962Water溶媒HCID 1140Toluene溶媒

実験手順

The compound (90 mg, 0.14 mmol) obtained in Example 74a was dissolved in a mixed solvent of methanol (1.4 mL) and water (1.4 mL), a 1 N aqueous sodium hydroxide solution (0.214 mL, 0.214 mmol) was added, and the mixture was stirred at room temperature for 3 hours and then at 50° C. for 2 hours. A 1 N aqueous hydrochloric acid solution (0.300 mL) and toluene were added, and then the solvent was evaporated under reduced pressure. The resulting residue and the compound (74 mg, 0.095 mmol) obtained in Example 1k were used to give the title compound (63 mg; yield, 48%) as a white solid according to the method described in Example 11e.

後処理

  1. waitat 50° C. for 2 hours
  2. customthe solvent was evaporated under reduced pressure

出典と根拠

ORDレコード
ord-9adb6f170a4b42b88f35e975c093cdaf
出典データセット
uspto-grants-2013_07
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08476253B2

反応ノート

読み込み中…

このページの内容参加物実験手順後処理出典と根拠反応ノート