HRID469060

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID81531

Diisopropylethylamine

C8H19N

HCID2796029

1H-Benzotriazol-1-ol--water (1/1)

C6H7N3O2

HCID5001227

3-(2-Aminoethyl)-1-Boc-piperidine

C12H24N2O2

结构：COc1cc(C)c(S(=O)(=O)N(Cc2nc(C(=O)O)co2)C2CC2)c(C)c1

HCID58393098

未命名化合物

PRODUCTS

生成物

结构：COc1cc(C)c(S(=O)(=O)N(Cc2nc(C(=O)NCCC3CCCNC3)co2)C2CC2)c(C)c1

HCID46175908

未命名化合物

结构：COc1cc(C)c(S(=O)(=O)N(Cc2nc(C(=O)NCCC3CCCN(C(=O)OC(C)(C)C)C3)co2)C2CC2)c(C)c1

HCID67328832

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

The title compound was prepared according to general procedure AH using 2-({cyclopropyl[(4-methoxy-2,6-dimethylphenyl)sulfonyl]amino}methyl)-1,3-oxazole-4-carboxylic acid (38 mg, 100 mop, EDCI (23 mg, 120 mop, HOBt monohydrate (18 mg, 120 μmol), DIPEA (69 μL, 400 mol), tert-butyl 3-(2-aminoethyl)piperidine-1-carboxylate (23 mg, 100 μmol) and DMF (750 L). The resulting crude compound was purified by FCC eluting with 100% EtOAc to afford tert-butyl 3-[2-({[2-({cyclopropyl[(4-methoxy-2,6-dimethylphenyl)sulfonyl]amino}methyl)-1,3-oxazol-4-yl]carbonyl}amino)ethyl]piperidine-1-carboxylate. Yield: 38 mg, 64%.

WORKUP

后处理

customThe resulting crude compound was purified by FCC
washeluting with 100% EtOAc

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c7eeac8c0c384b4f8cfbf505a0051400
来源数据集: uspto-grants-2014_01
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08623859B2
来源说明: uspto-grants-2014_01

反应 SMILES

[CH:1]1([N:4]([CH2:18][C:19]2[O:20][CH:21]=[C:22]([C:24](O)=[O:25])[N:23]=2)[S:5]([C:8]2[C:13]([CH3:14])=[CH:12][C:11]([O:15][CH3:16])=[CH:10][C:9]=2[CH3:17])(=[O:7])=[O:6])[CH2:3][CH2:2]1.CCN=C=NCCCN(C)C.C1C=C2N=NN(O)C2=CC=1.O.CCN(C(C)C)C(C)C.[NH2:58][CH2:59][CH2:60][CH:61]1[CH2:66][CH2:65][CH2:64][N:63]([C:67]([O:69][C:70]([CH3:73])([CH3:72])[CH3:71])=[O:68])[CH2:62]1>CN(C=O)C>[CH:1]1([N:4]([CH2:18][C:19]2[O:20][CH:21]=[C:22]([C:24]([NH:58][CH2:59][CH2:60][CH:61]3[CH2:66][CH2:65][CH2:64][NH:63][CH2:62]3)=[O:25])[N:23]=2)[S:5]([C:8]2[C:13]([CH3:14])=[CH:12][C:11]([O:15][CH3:16])=[CH:10][C:9]=2[CH3:17])(=[O:6])=[O:7])[CH2:2][CH2:3]1.[CH:1]1([N:4]([CH2:18][C:19]2[O:20][CH:21]=[C:22]([C:24]([NH:58][CH2:59][CH2:60][CH:61]3[CH2:66][CH2:65][CH2:64][N:63]([C:67]([O:69][C:70]([CH3:73])([CH3:72])[CH3:71])=[O:68])[CH2:62]3)=[O:25])[N:23]=2)[S:5]([C:8]2[C:9]([CH3:17])=[CH:10][C:11]([O:15][CH3:16])=[CH:12][C:13]=2[CH3:14])(=[O:6])=[O:7])[CH2:2][CH2:3]1