1-(4-Acetylaminophenyl)-3-acetyl-4-methyl-7,8-methylenedioxy-3,4-dihydro-5H-2,3-benzodiazepine

Base Information

• Chemical Name: 1-(4-Acetylaminophenyl)-3-acetyl-4-methyl-7,8-methylenedioxy-3,4-dihydro-5H-2,3-benzodiazepine
• CAS No.: 143692-53-9
• Molecular Formula: C₂₁H₂₁N₃O₄
• Molecular Weight: 379.415
• DSSTox Substance ID: DTXSID70931993
• Nikkaji Number: J746.354E
• Mol file: 143692-53-9.mol

Synonyms:143692-53-9;1-(4-Acetylaminophenyl)-3-acetyl-4-methyl-7,8-methylenedioxy-3,4-dihydro-5H-2,3-benzodiazepine;Acetamide, N-(4-(7-acetyl-8,9-dihydro-8-methyl-7H-1,3-dioxolo(4,5-h)(2,3)benzodiazepin-5-yl)phenyl)-;1-(4-Acetylaminophenyl)-3-acetyl-4-methyl-7,8-methylenedioxy-3,4-dihyd ro-5H-2,3-benzodiazepine;N-[4-(7-acetyl-8-methyl-8,9-dihydro-[1,3]dioxolo[4,5-h][2,3]benzodiazepin-5-yl)phenyl]acetamide;SCHEMBL8792227;DTXSID70931993;LS-7964;5-[4-(Acetylamino)phenyl]-8-methyl-7-acetyl-8,9-dihydro-7H-1,3-dioxolo[4,5-h][2,3]benzodiazepine;N-[4-(7-Acetyl-8-methyl-8,9-dihydro-2H,7H-[1,3]dioxolo[4,5-h][2,3]benzodiazepin-5-yl)phenyl]ethanimidic acid

Chemical Property of 1-(4-Acetylaminophenyl)-3-acetyl-4-methyl-7,8-methylenedioxy-3,4-dihydro-5H-2,3-benzodiazepine

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 83.72000
• Density: 1.34g/cm³
• LogP: 2.94220
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 379.15320616
• Heavy Atom Count: 28
• Complexity: 644

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC2=CC3=C(C=C2C(=NN1C(=O)C)C4=CC=C(C=C4)NC(=O)C)OCO3

Technology Process of 1-(4-Acetylaminophenyl)-3-acetyl-4-methyl-7,8-methylenedioxy-3,4-dihydro-5H-2,3-benzodiazepine

There total 3 articles about 1-(4-Acetylaminophenyl)-3-acetyl-4-methyl-7,8-methylenedioxy-3,4-dihydro-5H-2,3-benzodiazepine 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:

talampanel (143691-37-6) → GYKI-53391 (143692-53-9)

Guidance literature:

With acetic anhydride; In ice-water; benzene;

Reference yield:

GYKI 52895 (114460-08-1,161832-72-0,161832-73-1) → GYKI-53391 (143692-53-9)

Guidance literature:

Multi-step reaction with 2 steps

1: acetic anhydride; triethylamine / chloroform

2: acetic anhydride / ice-water; benzene

With acetic anhydride; triethylamine; In ice-water; chloroform; benzene;

Reference yield:

→ GYKI-53391 (143692-53-9)

Guidance literature:

upstream raw materials:

talampanel

GYKI 52895