6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(2,2-dimethylpropyl)-1-piperazinyl)acetyl)-

Base Information

• Chemical Name: 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(2,2-dimethylpropyl)-1-piperazinyl)acetyl)-
• CAS No.: 69628-22-4
• Molecular Formula: C₂₃H₂₉N₅O₂
• Molecular Weight: 407.516
• DSSTox Substance ID: DTXSID00219892
• Wikidata: Q83096921

Synonyms:69628-22-4;6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(2,2-dimethylpropyl)-1-piperazinyl)acetyl)-;SCHEMBL11448371;DTXSID00219892;CACHESWDTFLQKE-UHFFFAOYSA-N;C23H29N5O2;LS-133114;5,11-Dihydro-11-{[4-(2,2-dimethyl-propyl)-1-piperazinyl]acetyl}-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one

Chemical Property of 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(2,2-dimethylpropyl)-1-piperazinyl)acetyl)-

Chemical Property:

• Vapor Pressure: 6.52E-13mmHg at 25°C
• Boiling Point: 567.9°Cat760mmHg
• Flash Point: 297.2°C
• Density: 1.185g/cm³
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 407.23212518
• Heavy Atom Count: 30
• Complexity: 626

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)CN1CCN(CC1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4

Technology Process of 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(2,2-dimethylpropyl)-1-piperazinyl)acetyl)-

There total 2 articles about 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-(2,2-dimethylpropyl)-1-piperazinyl)acetyl)- 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: 40.0%

1-(2,2-dimethyl-propyl)-piperazine (57184-50-6) + 11-(chloroacetyl)-5,11-dihydro-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one (28797-48-0) → 11-{[4-(2,2-dimethyl-propyl)-piperazin-1-yl]-acetyl}-5,11-dihydro-benzo[e]pyrido[3,2-b][1,4]diazepin-6-one (69628-22-4)

Guidance literature:

With potassium carbonate; In ethanol;

Reference yield:

→ 11-{[4-(2,2-dimethyl-propyl)-piperazin-1-yl]-acetyl}-5,11-dihydro-benzo[e]pyrido[3,2-b][1,4]diazepin-6-one (69628-22-4)

Guidance literature:

11-Chloracetyl-Derivat, 1-(2,2-Dimethyl-propyl)-piperazin;

upstream raw materials:

1-(2,2-dimethyl-propyl)-piperazine

11-(chloroacetyl)-5,11-dihydro-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one

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