4-methoxy-N-phenylbenzenesulfonamide

Base Information

• Chemical Name: 4-methoxy-N-phenylbenzenesulfonamide
• CAS No.: 1146-41-4
• Molecular Formula: C13H13NO3S
• Molecular Weight: 263.317
• DSSTox Substance ID: DTXSID50902045
• Nikkaji Number: J2.387.050I
• ChEMBL ID: CHEMBL182454
• Mol file: 1146-41-4.mol

Synonyms:4-methoxy-N-phenylbenzenesulfonamide;1146-41-4;PCMD-CC-MCM-211;4-Methoxy-N-phenyl-benzenesulfonamide;Benzenesulfonamide, 4-methoxy-N-phenyl-;4-methoxy-~{N}-phenyl-benzenesulfonamide;PC-0596528;starbld0028116;NoName_1248;Oprea1_012199;Oprea1_559923;MLS001045554;SCHEMBL812663;CHEMBL182454;cid_835273;BDBM43300;DTXSID50902045;HMS2798H22;N-Phenyl-4-methoxybenzenesulfonamide;MFCD00519219;STL416397;N-phenyl-4'-methoxybenzenesulfonamide;AKOS000383757;4-methoxy-N-phenylbenzene-1-sulfonamide;SMR000469558;A1-03794;Z45619481;YCY

Chemical Property of 4-methoxy-N-phenylbenzenesulfonamide

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 263.06161445
• Heavy Atom Count: 18
• Complexity: 336

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2

Technology Process of 4-methoxy-N-phenylbenzenesulfonamide

There total 15 articles about 4-methoxy-N-phenylbenzenesulfonamide 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: 100.0%

N-(2,3-dimethylbut-2-enyl)-4-methoxy-N-phenylbenzenesulfonamide → 4-methoxy-N-phenylbenzenesulfonamide (1146-41-4)

Guidance literature:

With triethylsilane; trifluoroacetic acid; In dichloromethane; at 20 ℃; for 0.333333h;

DOI:10.1055/s-0034-1379428

Reference yield: 97.0%

N-(2-chloro-1-phenylethyl)-N-fluoro-4-methoxybenzenesulfonamide → 2-chloroethanal (107-20-0) + 4-methoxy-N-phenylbenzenesulfonamide (1146-41-4)

Guidance literature:

With formic acid; at 50 ℃; for 1h; Temperature;

DOI:10.1021/acs.joc.8b01841

Reference yield: 96.0%

4-methoxybenzenesulfonyl azide (4547-64-2) + phenylboronic acid (98-80-6) → 4-methoxy-N-phenylbenzenesulfonamide (1146-41-4)

Guidance literature:

With L-proline-functionalized MCM-41-immobilized-CuCl; air; In methanol; at 20 ℃; for 2h;

DOI:10.1039/c6ra04298h

upstream raw materials:

4-methoxybenzenesulfonyl azide

benzene

aniline

4-methoxy-phenyl-sulphonyl chloride

Downstream raw materials:

Ethyl N-Phenyl-N-p-methoxybenzenesulfonyl-γ-aminobutyrate

ethyl N-phenyl-N-p-methoxybenzenesulfonyl-glycinate

N-isobutyl-4-methoxy-N-phenylbenzenesulfonamide

Refernces

• 1、 Bernar, Ivan,Blanco-Ania, Daniel,Stok, Sophie J.,Sotorríos, Lia,Gómez-Bengoa, Enrique,Rutjes, Floris P. J. T.. "Synthesis of 3-Amino-1-benzothiophene-1,1-diones by Alkyne Directed Hydroarylation and 1/N→3/C-Sulfonyl Migration". . p. 5435 - 5444. Retrieved 2018.
• 2、 Al-Rashida, Mariya,Ali, Deedar,Amjad, Sayyeda Tayyeba,Hameed, Abdul,Iftikhar, Shafia,Iqbal, Jamshed,Naseer, Muhammad Moazzam,Shafique, Zainab,Shah, Muhammad Raza,Sindhu, Tayyaba Allamgir. "Utilization of transition metal fluoride-based solid support catalysts for the synthesis of sulfonamides: Carbonic anhydrase inhibitory activity and: In silico study". . p. 3165 - 3179. Retrieved 2022/02/05.
• 3、 Pallesen, Jakob S.,Narayanan, Dilip,Tran, Kim T.,Solbak, Sara M. ?.,Marseglia, Giuseppe,S?rensen, Louis M. E.,H?j, Lars J.,Munafò, Federico,Carmona, Rosa M. C.,Garcia, Anthony D.,Desu, Haritha L.,Brambilla, Roberta,Johansen, Tommy N.,Popowicz, Grzegorz M.,Sattler, Michael,Gajhede, Michael,Bach, Anders. "Deconstructing Noncovalent Kelch-like ECH-Associated Protein 1 (Keap1) Inhibitors into Fragments to Reconstruct New Potent Compounds". . p. 4623 - 4661. Retrieved 2021/05/07.