6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((2-methyl-1H-imidazol-1-yl)acetyl)-

Base Information

Chemical Name:6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((2-methyl-1H-imidazol-1-yl)acetyl)-
CAS No.:79276-55-4
Molecular Formula:C₁₈H₁₅N₅O₂
Molecular Weight:333.349
Hs Code.:
DSSTox Substance ID:DTXSID70229600
Wikidata:Q83109898

Synonyms:BRN 4718126;6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((2-methyl-1H-imidazol-1-yl)acetyl)-;11-((2-Methyl-1H-imidazol-1-yl)acetyl)-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one;79276-55-4;DTXSID70229600;LS-133125

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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

Chemical Property:

Vapor Pressure:3.19E-14mmHg at 25°C
Boiling Point:597.1°Cat760mmHg
Flash Point:314.9°C
Density:1.4g/cm³
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:333.12257474
Heavy Atom Count:25
Complexity:528

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=NC=CN1CC(=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-((2-methyl-1H-imidazol-1-yl)acetyl)-

There total 11 articles about 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((2-methyl-1H-imidazol-1-yl)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: 47.5%

: 693-98-1
2-methylimidazole

: 28797-48-0
11-(chloroacetyl)-5,11-dihydro-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one

: 79276-55-4
5,11-dihydro-11-<(2'-methylimidazo-1'-yl)-acetyl>-6H-pyrido<2,3-b><1,4>benzodiazepin-6-one

Guidance literature:: In benzene; for 1.5h; Heating;

Reference yield:

: 84446-13-9
1-oxo-5,11-dihydro-11-(2''-methylimidazol-1''-yl)acetyl-6H-pyrido<2,3-b><1,4>benzodiazepin-6-one

: 79276-55-4
5,11-dihydro-11-<(2'-methylimidazo-1'-yl)-acetyl>-6H-pyrido<2,3-b><1,4>benzodiazepin-6-one

Guidance literature:: With hydrogen; nickel; In various solvent(s); at 50 ℃; for 16h;

Reference yield:

: 84446-21-9
3-(2'-chlorobenzoyl)amino-2-chloropyridine

: 79276-55-4
5,11-dihydro-11-<(2'-methylimidazo-1'-yl)-acetyl>-6H-pyrido<2,3-b><1,4>benzodiazepin-6-one

Guidance literature:: Multi-step reaction with 6 steps

1: 90 percent / 40percent H₂O₂, acetic acid / 24 h / 55 - 60 °C / bath temperature

2: 8.96 g / conc. NH₄OH, CuSO₄*5H₂O, NaCl / 5 h / 80 °C

3: 96 percent / 5percent aq. HCl / various solvent(s) / 1.5 h / 110 °C / bath temperature

4: acetonitrile / 2 h / 80 °C

5: 100 percent / toluene / 2 h / 80 °C

6: H₂ / Raney nickel / various solvent(s) / 16 h / 50 °C

With hydrogenchloride; ammonium hydroxide; hydrogen; dihydrogen peroxide; copper(II) sulfate; acetic acid; sodium chloride; nickel; In toluene; acetonitrile;