Tert-butyl 4-[(4-methoxyphenyl)sulfonyl]piperazine-1-carboxylate

Base Information

• Chemical Name: Tert-butyl 4-[(4-methoxyphenyl)sulfonyl]piperazine-1-carboxylate
• CAS No.: 588692-07-3
• Molecular Formula: C₁₆H₂₄N₂O₅S
• Molecular Weight: 356.443
• DSSTox Substance ID: DTXSID201151393
• Mol file: 588692-07-3.mol

Synonyms:588692-07-3;1-Piperazinecarboxylic acid, 4-[(4-methoxyphenyl)sulfonyl]-, 1,1-dimethylethyl ester;Oprea1_368543;SCHEMBL18153290;DTXSID201151393;STK435992;AKOS003321922;t-butyl 4-((4-methoxyphenyl)sulfonyl)piperazine-1-carboxylate;tert-butyl 4-[(4-methoxyphenyl)sulfonyl]piperazine-1-carboxylate;1,1-Dimethylethyl 4-[(4-methoxyphenyl)sulfonyl]-1-piperazinecarboxylate

Chemical Property of Tert-butyl 4-[(4-methoxyphenyl)sulfonyl]piperazine-1-carboxylate

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 356.14059304
• Heavy Atom Count: 24
• Complexity: 522

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OC

Technology Process of Tert-butyl 4-[(4-methoxyphenyl)sulfonyl]piperazine-1-carboxylate

There total 1 articles about Tert-butyl 4-[(4-methoxyphenyl)sulfonyl]piperazine-1-carboxylate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 88.0%

4-methoxy-phenyl-sulphonyl chloride (98-68-0) + 1-t-Butoxycarbonylpiperazine (57260-71-6) → tert-butyl 4-((4-methoxyphenyl)sulfonyl)piperazine-1-carboxylate (588692-07-3)

Guidance literature:

With dmap; triethylamine; In dichloromethane; at 40 ℃; for 12h; Inert atmosphere;

DOI:10.1021/acsmedchemlett.5b00202

Reference yield: 100.0%

tert-butyl 4-((4-methoxyphenyl)sulfonyl)piperazine-1-carboxylate (588692-07-3) → 1‐(4‐methoxyphenylsulfonyl)piperazine (121751-67-5)

Guidance literature:

With hydrogenchloride; water; In 1,4-dioxane;

DOI:10.1021/co1000508

Reference yield: 72.0%

tert-butyl 4-((4-methoxyphenyl)sulfonyl)piperazine-1-carboxylate (588692-07-3) → {4-[(4-hydroxyphenyl)sulfonyl]piperazin-1-yl}phenylmethanone

Guidance literature:

With boron tribromide; In dichloromethane; at 0 - 20 ℃; for 12h;

DOI:10.1021/acsmedchemlett.5b00202

upstream raw materials:

4-methoxy-phenyl-sulphonyl chloride

1-t-Butoxycarbonylpiperazine

Downstream raw materials:

C₂₁H₂₇N₃O₆S

1‐(4‐methoxyphenylsulfonyl)piperazine

1-((2,6-difluorophenyl)sulfonyl)-4-((4-methoxyphenyl)sulfonyl)piperazine

2-(4-(4-methoxybenzenesulfonyl)piperazin-1-yl) acetic acid