HRID1897706

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8083

Morpholine

C4H9NO

结构：Cc1cc(Nc2nc(Nc3cc(C)c(C4CCN(S(=O)(=O)CCCCl)CC4)cc3C)ncc2Cl)n[nH]1

HCID67155571

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(Nc2nc(Nc3cc(C)c(C4CCN(S(=O)(=O)CCCN5CCOCC5)CC4)cc3C)ncc2Cl)n[nH]1

HCID44611902

未命名化合物

PROCEDURE

实验过程

The product from Step 1 was stirred in neat morpholine (0.5 mL) at 100° C. in a sealed vial for one hour. The reaction was purified by RP-HPLC to give 5-Chloro-N2-(2,5-dimethyl-4-(1-(3-morpholinopropylsulfonyl)piperidin-4-yl)phenyl)-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine as a white powder; ESMS m/z 603.2 (M+H+).

WORKUP

后处理

customThe reaction was purified by RP-HPLC

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5fad01e1515a4173a840ec60eb6a6c12
来源数据集: uspto-grants-2013_08
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08519129B2
来源说明: uspto-grants-2013_08

反应 SMILES

[Cl:1][C:2]1[C:3]([NH:30][C:31]2[CH:35]=[C:34]([CH3:36])[NH:33][N:32]=2)=[N:4][C:5]([NH:8][C:9]2[CH:14]=[C:13]([CH3:15])[C:12]([CH:16]3[CH2:21][CH2:20][N:19]([S:22]([CH2:25][CH2:26][CH2:27]Cl)(=[O:24])=[O:23])[CH2:18][CH2:17]3)=[CH:11][C:10]=2[CH3:29])=[N:6][CH:7]=1.[NH:37]1[CH2:42][CH2:41][O:40][CH2:39][CH2:38]1>>[Cl:1][C:2]1[C:3]([NH:30][C:31]2[CH:35]=[C:34]([CH3:36])[NH:33][N:32]=2)=[N:4][C:5]([NH:8][C:9]2[CH:14]=[C:13]([CH3:15])[C:12]([CH:16]3[CH2:21][CH2:20][N:19]([S:22]([CH2:25][CH2:26][CH2:27][N:37]4[CH2:42][CH2:41][O:40][CH2:39][CH2:38]4)(=[O:24])=[O:23])[CH2:18][CH2:17]3)=[CH:11][C:10]=2[CH3:29])=[N:6][CH:7]=1