HRID74675

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID81531

Diisopropylethylamine

C8H19N

结构：CN(C)C(On1nnc2ccccc21)=[N+](C)C.F[B-](F)(F)F

HCID2733207

O-(Benzotriazol-1-yl)-N,N,N′,N′-tetramethyluronium tetrafluoroborate

C11H16BF4N5O

结构：COc1ccc2c(c1)CCN(C1CCN(c3cc(C(=O)O)ncn3)CC1)C(=O)N2

HCID58386616

未命名化合物

HCID86656500

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2c(c1)CCN(C1CCN(c3cc(C(=O)N4CC[C@H]5CCCC[C@@H]5C4)ncn3)CC1)C(=O)N2

HCID67338157

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID6228

N,N-Dimethylformamide

C3H7NO

PROCEDURE

实验过程

Analogously to decahydroisoquinoline-2-carbonyl)pyrimidin-4-yl)piperidin-4-yl)-7-methoxy-4,5-dihydro-1H-benzo[d][1,3]diazepin-2(3H)-one the following compounds were prepared from 4.0 mg (10 μmol) 6-[4-(7-methoxy-2-oxo-1,2,4,5-tetrahydro-1,3-benzodiazepin-3-yl)-piperidin-1-yl]-pyrimidine-4-carboxylic acid, 3.6 mg (11 μmol) TBTU, 12 μmol of the corresponding amine and 3.9 μL DIPEA in 350 μL DMF:

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0179ff19cc2b4e7cb2cc97cd4ea89984
来源数据集: uspto-grants-2014_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08829006B2
来源说明: uspto-grants-2014_09

反应 SMILES

CO[C:3]1[CH:14]=[CH:13][C:6]2N[C:8](=O)[NH:9][CH2:10][CH2:11][C:5]=2[CH:4]=1.[CH3:15][O:16][C:17]1[CH:18]=[CH:19][C:20]2[NH:26][C:25](=[O:27])[N:24]([CH:28]3[CH2:33][CH2:32][N:31]([C:34]4[N:39]=[CH:38][N:37]=[C:36]([C:40](O)=[O:41])[CH:35]=4)[CH2:30][CH2:29]3)[CH2:23][CH2:22][C:21]=2[CH:43]=1.CN(C(ON1N=NC2C=CC=CC1=2)=[N+](C)C)C.[B-](F)(F)(F)F.CCN(C(C)C)C(C)C>CN(C=O)C>[CH2:8]1[C@@H:6]2[C@H:5]([CH2:4][CH2:3][CH2:14][CH2:13]2)[CH2:11][CH2:10][N:9]1[C:40]([C:36]1[N:37]=[CH:38][N:39]=[C:34]([N:31]2[CH2:32][CH2:33][CH:28]([N:24]3[CH2:23][CH2:22][C:21]4[CH:43]=[C:17]([O:16][CH3:15])[CH:18]=[CH:19][C:20]=4[NH:26][C:25]3=[O:27])[CH2:29][CH2:30]2)[CH:35]=1)=[O:41]