10H-Thieno(2,3-b)(1,5)benzodiazepine, 2-ethyl-8-methyl-4-(4-methyl-1-piperazinyl)-

Base Information

• Chemical Name: 10H-Thieno(2,3-b)(1,5)benzodiazepine, 2-ethyl-8-methyl-4-(4-methyl-1-piperazinyl)-
• CAS No.: 61325-77-7
• Molecular Formula: C19H24N4S
• Molecular Weight: 340.4857
• DSSTox Substance ID: DTXSID40210227
• ChEMBL ID: CHEMBL354425

Synonyms:BRN 1034585;10H-Thieno(2,3-b)(1,5)benzodiazepine, 2-ethyl-8-methyl-4-(4-methyl-1-piperazinyl)-;2-Ethyl-8-methyl-4-(4-methyl-1-piperazinyl)-10H-thieno(2,3-b)(1,5)benzodiazepine;61325-77-7;CHEMBL354425;C19H24N4S;DTXSID40210227;LS-152286

Chemical Property of 10H-Thieno(2,3-b)(1,5)benzodiazepine, 2-ethyl-8-methyl-4-(4-methyl-1-piperazinyl)-

Chemical Property:

• Vapor Pressure: 4.51E-10mmHg at 25°C
• Boiling Point: 498.5°Cat760mmHg
• Flash Point: 255.3°C
• Density: 1.27g/cm³
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 340.17216796
• Heavy Atom Count: 24
• Complexity: 474

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=CC2=C(S1)NC3=C(C=CC(=C3)C)N=C2N4CCN(CC4)C

Technology Process of 10H-Thieno(2,3-b)(1,5)benzodiazepine, 2-ethyl-8-methyl-4-(4-methyl-1-piperazinyl)-

There total 2 articles about 10H-Thieno(2,3-b)(1,5)benzodiazepine, 2-ethyl-8-methyl-4-(4-methyl-1-piperazinyl)- 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: 68.0%

1-methyl-piperazine (109-01-3) + 2-ethyl-8-methyl-5,10-dihydro-benzo[b]thieno[2,3-e][1,4]diazepin-4-one (61325-44-8) → 2-ethyl-8-methyl-4-(4-methyl-piperazin-1-yl)-10H-benzo[b]thieno[2,3-e][1,4]diazepine (61325-77-7)

Guidance literature:

With titanium tetrachloride; In various solvent(s); at 120 ℃; for 2h;

DOI:10.1021/jm00182a013

Reference yield:

→ 2-ethyl-8-methyl-4-(4-methyl-piperazin-1-yl)-10H-benzo[b]thieno[2,3-e][1,4]diazepine (61325-77-7)

Guidance literature:

entspr. Diazepinon, entspr. Amin;

upstream raw materials:

1-methyl-piperazine

2-ethyl-8-methyl-5,10-dihydro-benzo[b]thieno[2,3-e][1,4]diazepin-4-one

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