N-(4-{2-[(7-Methoxy-3-methylquinolin-2-yl)sulfanyl]acetamido}-2-methylphenyl)propanamide

Base Information

• Chemical Name: N-(4-{2-[(7-Methoxy-3-methylquinolin-2-yl)sulfanyl]acetamido}-2-methylphenyl)propanamide
• CAS No.: 3891-47-2
• Molecular Formula: C23H25N3O3S
• Molecular Weight: 423.5279
• DSSTox Substance ID: DTXSID20360799
• Wikidata: Q82142744
• Mol file: 3891-47-2.mol

Synonyms:3891-47-2;Oprea1_431801;DTXSID20360799;AKOS000796841;N-(4-{2-[(7-Methoxy-3-methylquinolin-2-yl)sulfanyl]acetamido}-2-methylphenyl)propanamide

Chemical Property of N-(4-{2-[(7-Methoxy-3-methylquinolin-2-yl)sulfanyl]acetamido}-2-methylphenyl)propanamide

Chemical Property:

• Vapor Pressure: 5.95E-18mmHg at 25°C
• Boiling Point: 672.6°C at 760 mmHg
• Flash Point: 360.6°C
• Density: 1.26g/cm³
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 423.16166284
• Heavy Atom Count: 30
• Complexity: 590

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(=O)NC1=C(C=C(C=C1)NC(=O)CSC2=NC3=C(C=CC(=C3)OC)C=C2C)C

Technology Process of N-(4-{2-[(7-Methoxy-3-methylquinolin-2-yl)sulfanyl]acetamido}-2-methylphenyl)propanamide

There total 4 articles about N-(4-{2-[(7-Methoxy-3-methylquinolin-2-yl)sulfanyl]acetamido}-2-methylphenyl)propanamide 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:

1,2-O-isopropylidene-α-D-glucofuranose (18549-40-1) → O1,O2-isopropylidene-O3,O5,O6-methanetriyl-α-D-glucofuranose (3891-47-2)

Guidance literature:

With formic acid; acetic anhydride;

Reference yield:

1,2:5,6-di-O-isopropylidene-α-D-glucofuranose (582-52-5) → O1,O2-isopropylidene-O3,O5,O6-methanetriyl-α-D-glucofuranose (3891-47-2)

Guidance literature:

With hydrogenchloride; methanol; orthoformic acid triethyl ester;

Reference yield:

D-glucose (50-99-7) + orthoformic acid triethyl ester (122-51-0) + acetone (67-64-1) → 1,2-O-isopropylidene-3,5,6-tri-O-orthoformyl-α-D-glucofuranose (3891-47-2)

Guidance literature:

With hydrogenchloride; sulfuric acid; Yield given. Multistep reaction; 2) methanol, room temperature;

upstream raw materials:

1,2-O-isopropylidene-α-D-glucofuranose

1,2:5,6-di-O-isopropylidene-α-D-glucofuranose

D-glucose

orthoformic acid triethyl ester