HRID583688

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID7972

4-Methylmorpholine

C5H11NO

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

结构：CC(C)(C)OC(=O)[C@H](CN)NS(=O)(=O)c1ccccc1.Cl

HCID22853534

未命名化合物

HCID67695646

未命名化合物

PRODUCTS

生成物

结构：CC(=O)O.CC(C)(C)OC(=O)[C@H](CNC(=O)c1ccc(CCc2ncc[nH]2)cc1)NS(=O)(=O)c1ccccc1

HCID86754337

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

Acid 23-5 (ca 2 mmol), amine 2-1 (700 mg, 2.0 mmol), HOBT (324 mg, 2.4 mmol), and NMM (0.77 mL, 7.0 mmol) were combined in 10 mL DMF at -15°, then EDC (364 mg, 1.9 mmol) was added The mixture was warmed to RT, stirred overnight, then concentrated. Flash chromatography (silica, 4:1:1 CH2Cl2 /MeOH/HOAc) provided 23-6, Rf 0.22 (silica, 4:1:1 CH2Cl2 :MeOH:HOAc).

WORKUP

后处理

concentrationconcentrated
customFlash chromatography (silica, 4:1:1 CH2Cl2 /MeOH/HOAc) provided 23-6, Rf 0.22 (silica, 4:1:1 CH2Cl2 :MeOH:HOAc)

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-62989eaa1423487aa2cff4ee25f181b4
来源数据集: uspto-grants-1999_07
DOI: 10.6084/m9.figshare.5104873.v1
专利: US05929120
来源说明: uspto-grants-1999_07

反应 SMILES

Cl.[NH:2]1[CH:6]=[CH:5][N:4]=[C:3]1[CH2:7][CH2:8][C:9]1[CH:17]=[CH:16][C:12]([C:13]([OH:15])=[O:14])=[CH:11][CH:10]=1.Cl.[NH2:19][CH2:20][C@H:21]([NH:29][S:30]([C:33]1[CH:38]=[CH:37][CH:36]=[CH:35][CH:34]=1)(=[O:32])=[O:31])[C:22]([O:24][C:25]([CH3:28])([CH3:27])[CH3:26])=[O:23].C1C=CC2N(O)N=NC=2C=1.CN1CCOCC1.C(Cl)CCl>CN(C=O)C>[C:13]([OH:15])(=[O:14])[CH3:12].[C:25]([O:24][C:22](=[O:23])[C@@H:21]([NH:29][S:30]([C:33]1[CH:38]=[CH:37][CH:36]=[CH:35][CH:34]=1)(=[O:32])=[O:31])[CH2:20][NH:19][C:13](=[O:15])[C:12]1[CH:11]=[CH:10][C:9]([CH2:8][CH2:7][C:3]2[NH:2][CH:6]=[CH:5][N:4]=2)=[CH:17][CH:16]=1)([CH3:28])([CH3:26])[CH3:27]