N-(4-bromophenyl)-2-cyano-3-(1,3-dimethyl-2-oxo-benzoimidazol-5-yl)prop-2-enamide

Base Information

Chemical Name:N-(4-bromophenyl)-2-cyano-3-(1,3-dimethyl-2-oxo-benzoimidazol-5-yl)prop-2-enamide
CAS No.:6517-75-5
Molecular Formula:C19H15BrN4O2
Molecular Weight:411.252
Hs Code.:
DSSTox Substance ID:DTXSID70410233

Synonyms:6517-75-5;N-(4-bromophenyl)-2-cyano-3-(1,3-dimethyl-2-oxo-benzoimidazol-5-yl)prop-2-enamide;DTXSID70410233

Suppliers and Price of N-(4-bromophenyl)-2-cyano-3-(1,3-dimethyl-2-oxo-benzoimidazol-5-yl)prop-2-enamide

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 1 raw suppliers

Chemical Property of N-(4-bromophenyl)-2-cyano-3-(1,3-dimethyl-2-oxo-benzoimidazol-5-yl)prop-2-enamide

Chemical Property:

Vapor Pressure:2.72E-15mmHg at 25°C
Boiling Point:619.9°Cat760mmHg
Flash Point:328.7°C
Density:1.552g/cm³
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:410.03784
Heavy Atom Count:26
Complexity:647

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:CN1C2=C(C=C(C=C2)C=C(C#N)C(=O)NC3=CC=C(C=C3)Br)N(C1=O)C

Technology Process of N-(4-bromophenyl)-2-cyano-3-(1,3-dimethyl-2-oxo-benzoimidazol-5-yl)prop-2-enamide

There total 6 articles about N-(4-bromophenyl)-2-cyano-3-(1,3-dimethyl-2-oxo-benzoimidazol-5-yl)prop-2-enamide 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: 75.0%

: 6698-80-2
3-methyl-1-phenyl-8-benzyl-3,8-diazaspiro<4,5>decane-2,4-dione

: 6517-75-5
3-methyl-1-phenyl-3,8-diazaspiro<4,5>decane-2,4-dione hydrochloride

Guidance literature:: With hydrogenchloride; hydrogen; palladium on activated charcoal; In ethanol; water; at 40 ℃;

Reference yield:

: 3612-20-2
1-phenylmethyl-4-piperidone

: 6517-75-5
3-methyl-1-phenyl-3,8-diazaspiro<4,5>decane-2,4-dione hydrochloride

Guidance literature:: Multi-step reaction with 4 steps

1: sodium ethoxide / ethanol / 3 h / Heating

2: 2.) hydrochloric acid / 1.) water, ethanol, reflux, 60 h; 2.) water, reflux, 30 h

3: 1.) sodium ethoxide / 1.) ethanol, 20 min; 2.) ethanol, dimethylformamide, 90 deg C, 3 h

4: 75 percent / hydrogen, 2N hydrocloric acid / 10percent Pd/C / ethanol; H₂O / 40 °C

With hydrogenchloride; hydrogen; sodium ethanolate; palladium on activated charcoal; In ethanol; water;

Reference yield:

: 6719-36-4
1-phenyl-8-benzyl-3,8-diazaspiro<4,5>decane-2,4-dione

: 6517-75-5
3-methyl-1-phenyl-3,8-diazaspiro<4,5>decane-2,4-dione hydrochloride

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) sodium ethoxide / 1.) ethanol, 20 min; 2.) ethanol, dimethylformamide, 90 deg C, 3 h

2: 75 percent / hydrogen, 2N hydrocloric acid / 10percent Pd/C / ethanol; H₂O / 40 °C

With hydrogenchloride; hydrogen; sodium ethanolate; palladium on activated charcoal; In ethanol; water;