HRID2191007

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CCOP(=O)(OCC)C(F)=CC1OC(n2cnc3c(NC(=O)c4ccccc4)ncnc32)C2OC(C)(C)OC12

HCID72247288

未命名化合物

结构：CCOP(=O)(C=CC1OC(n2nnc3c(NC(=O)c4ccccc4)ncnc32)C(O)C1O)OCC

HCID74948506

未命名化合物

PRODUCTS

生成物

结构：CCOP(=O)(OCC)C(F)=CC1OC(n2cnc3c(NC(=O)c4ccccc4)ncnc32)C(O)C1O

HCID72247317

未命名化合物

收率 76%

PROCEDURE

实验过程

Compound 7.4 (70 mg, 76% yield) was synthesized from compound 7.3 (100 mg) using the procedure described for the preparation for compound 6.5. 1HNMR (300 MHz, CD3CN) δ 1.21-1.38 (m, 6H), 4.06-4.24 (m, 4H), 4.47 (s, 1H), 4.92 (s, 1H), 5.00 (s, 1H), 6.08 (d, 1H, J=4.8), 6.31-6.47 (m, 1H), 7.57-8.06 (m, 5H), 8.31 (s, 1H), 8.72 (s, 1H).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-529b9819b87241ddbaff2b34ac9d7e3f
来源数据集: uspto-grants-2012_12
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08324179B2
来源说明: uspto-grants-2012_12

反应 SMILES

[CH2:1]([O:3][P:4]([C:9]([F:39])=[CH:10][CH:11]1[CH:18]2[CH:14]([O:15]C(C)(C)[O:17]2)[CH:13]([N:21]2[CH:29]=[N:28][C:27]3[C:22]2=[N:23][CH:24]=[N:25][C:26]=3[NH:30][C:31](=[O:38])[C:32]2[CH:37]=[CH:36][CH:35]=[CH:34][CH:33]=2)[O:12]1)(=[O:8])[O:5][CH2:6][CH3:7])[CH3:2].C(OP(C=CC1C(O)C(O)C(N2C3N=CN=C(NC(=O)C4C=CC=CC=4)C=3N=N2)O1)(=O)OCC)C>>[CH2:6]([O:5][P:4]([C:9]([F:39])=[CH:10][CH:11]1[CH:18]([OH:17])[CH:14]([OH:15])[CH:13]([N:21]2[CH:29]=[N:28][C:27]3[C:22]2=[N:23][CH:24]=[N:25][C:26]=3[NH:30][C:31](=[O:38])[C:32]2[CH:33]=[CH:34][CH:35]=[CH:36][CH:37]=2)[O:12]1)(=[O:8])[O:3][CH2:1][CH3:2])[CH3:7]