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Thiophenol → Amino-noscapine

HRID 2408264
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HRID 2408264 반응식
Cl[Sn]Cl.C1(S)C=CC=CC=1.C1(N(C2C=CC=CC=2)C2C=CC=CC=2)C=CC=CC=1.[N:30]([C:33]1[C:34]2[CH2:35][CH2:36][N:37]([CH3:62])[C@@H:38]([C@@H:48]3[C:56]4[C:51](=[C:52]([O:59][CH3:60])[C:53]([O:57][CH3:58])=[CH:54][CH:55]=4)[C:50](=[O:61])[O:49]3)[C:39]=2[C:40]([O:46][CH3:47])=[C:41]2[O:45][CH2:44][O:43][C:42]=12)=[N+]=[N-]>C1COCC1>[CH3:62][N:37]1[C@@H:38]([C@H:48]2[O:49][C:50](=[O:61])[C:51]3[C:52]([O:59][CH3:60])=[C:53]([O:57][CH3:58])[CH:54]=[CH:55][C:56]2=3)[C:39]2[C:40]([O:46][CH3:47])=[C:41]3[O:45][CH2:44][O:43][C:42]3=[C:33]([NH2:30])[C:34]=2[CH2:35][CH2:36]1
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참가 물질

6

반응물 4

HCID 7969ThiophenolHCID 11775TriphenylamineHCID 24479Stannous ChlorideHCID 86659030(S)-3-((R)-9-azido-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-6,7-dimethoxyisobenzofuran-1(3H)-one

생성물 1

HCID 46175165Amino-noscapine

시약·촉매·용매 1

HCID 8028
Tetrahydrofuran
용매
2회

실험 절차

To a 50-mL of round-bottomed flask containing a solution of SnCl2 in THF (10 mL) were added thiophenol and triphenylamine. The reaction mixture was added slowly to a solution of azido-noscapine (3, 0.2 g, 0.440 mmol) in THF (5 mL) and the reaction mixture stirred at room temperature. The reaction progress was monitored by thin-layer chromatography at 30 minutes intervals. The reaction was found to be completed after 2 h, the solvent was removed in vacuo. The residue was diluted with chloroform (20 ml) and was added sodium hydroxide solution (20 mL). the aqueous phase was separated and extracted with chloroform (2×20 mL). the combined organic phase was dried over sodium sulfate and concentrated to obtain amino-noscapine as colorless oil, which was then treated with ethereal HCl to obtain its salt as white crystals. Yield, 83%; mp (HCl. Salt) 112.2-112.6° C.; IR: 1725, 1362 cm−1; 1H NMR (CDCl3, 400 MHz): δ 7.12 (d, 1H, J=7.4.0 Hz), 7.02 (d, 1H, J=7.4 Hz), 6.02 (s, 2H), 5.92 (d, 1H, J=4.0 Hz), 4.42 (d, 1H, J=4.0 Hz), 4.20 (bs, 2H), 4.02 (s, 3H), 3.85 (s, 3H), 3.80 (s, 3H), 2.74-2.64 (m, 2H), 2.61-2.56 (m, 2H), 2.52 (s, 3H); 1H NMR (CDCl3+D2O, 400 MHz): δ 7.12 (d, 1H, J=7.4.0 Hz), 7.02 (d, 1H, J=7.4 Hz), 6.02 (s, 2H), 5.92 (d, 1H, J=4.0 Hz), 4.42 (d, 1H, J=4.0 Hz), 5.12 (bs, confirms NH2 group), 4.02 (s, 3H), 3.85 (s, 3H), 3.80 (s, 3H), 2.74-2.64 (m, 2H), 2.61-2.56 (m, 2H), 2.52 (s, 3H); 13C NMR (CDCl3, 100 MHz): δ 169.5, 156.8, 152.6, 147.8, 142.7, 141.8, 135.0, 134.2, 123.2, 120.8, 119.9, 119.4, 114.1, 100.8, 87.6, 63.7, 56.8, 56.4, 56.1, 51.4, 39.2, 27.5; HRMS (ESI): m/z Calcd. for C22H24N2O7 (M+1), 428.3481; Found, 428.1562 (M+1).

후처리

  1. waitto be completed after 2 h
  2. customthe solvent was removed in vacuo
  3. additionThe residue was diluted with chloroform (20 ml)
  4. additionwas added sodium hydroxide solution (20 mL)
  5. customthe aqueous phase was separated
  6. extractionextracted with chloroform (2×20 mL)
  7. dry with materialthe combined organic phase was dried over sodium sulfate
  8. concentrationconcentrated

출처 및 근거

ORD 기록
ord-1f7b9d70a8674372819e26ae8364aefe
출처 데이터셋
uspto-grants-2014_08
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08815835B2

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