HRID1396964

反应详情

EQUATION

反应方程式

REACTANTS

反应物

反应SMILES：O=CN(C[C@@H](CC1CCCC1)C(=O)N1[C@H](C(=O)Nc2nccc(-c3ccccn3)n2)CCN1C(=O)OCc1ccccc1)OC1CCCCO1

HCID131732107

未命名化合物

PRODUCTS

产物

反应SMILES：O=CN(O)C[C@@H](CC1CCCC1)C(=O)N1[C@H](C(=O)Nc2nccc(-c3ccccn3)n2)CCN1C(=O)OCc1ccccc1

HCID131732109

未命名化合物

收率 9.1%

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID21899381

Acetic acid--water (1/1)

C2H6O3

PROCEDURE

实验过程

A solution of phenylmethyl (3S)-2-((2R)-3-cyclopentyl-2-{[formyl(tetrahydro-2H-pyran-2-yloxy)amino]methyl}propanoyl)-3-({[4-(2-pyridinyl)-2-pyrimidinyl]amino}carbonyl)-1-pyrazolidinecarboxylate in AcOH/water (5 mL, 4:1) was stirred at rt for 48 h. The solvents were removed under vacuum and the residue was purified by RP-HPLC to provide the title compound (32 mg, 9.1%) as light-yellow gum.

WORKUP

后处理

customThe solvents were removed under vacuum
customthe residue was purified by RP-HPLC

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-51a8699dbdd14ac782fe40c5fa6445ac
来源数据集: uspto-grants-2014_12
DOI: 10.6084/m9.figshare.5104873.v1
专利号: US08901119B2
来源说明: uspto-grants-2014_12

反应SMILES

[CH:1]1([CH2:6][C@H:7]([CH2:40][N:41]([CH:49]=[O:50])[O:42]C2CCCCO2)[C:8]([N:10]2[C@H:14]([C:15]([NH:17][C:18]3[N:23]=[C:22]([C:24]4[CH:29]=[CH:28][CH:27]=[CH:26][N:25]=4)[CH:21]=[CH:20][N:19]=3)=[O:16])[CH2:13][CH2:12][N:11]2[C:30]([O:32][CH2:33][C:34]2[CH:39]=[CH:38][CH:37]=[CH:36][CH:35]=2)=[O:31])=[O:9])[CH2:5][CH2:4][CH2:3][CH2:2]1>CC(O)=O.O>[CH:1]1([CH2:6][C@H:7]([CH2:40][N:41]([CH:49]=[O:50])[OH:42])[C:8]([N:10]2[C@H:14]([C:15]([NH:17][C:18]3[N:23]=[C:22]([C:24]4[CH:29]=[CH:28][CH:27]=[CH:26][N:25]=4)[CH:21]=[CH:20][N:19]=3)=[O:16])[CH2:13][CH2:12][N:11]2[C:30]([O:32][CH2:33][C:34]2[CH:39]=[CH:38][CH:37]=[CH:36][CH:35]=2)=[O:31])=[O:9])[CH2:5][CH2:4][CH2:3][CH2:2]1