4-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)-2-trifluoromethylbenzonitrile

Base Information

Chemical Name:4-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)-2-trifluoromethylbenzonitrile
CAS No.:143782-20-1
Molecular Formula:C13H10F3N3O2
Molecular Weight:297.237
Hs Code.:2933990090
UNII:6PAG4TC385
DSSTox Substance ID:DTXSID901143349
Nikkaji Number:J1.523.114I
Wikipedia:Cyanonilutamide
Pharos Ligand ID:MAA1UWZN9C9A
ChEMBL ID:CHEMBL146858
Mol file:143782-20-1.mol

Synonyms:143782-20-1;4-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)-2-trifluoromethylbenzonitrile;Cyanonilutamide;4-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-2-(trifluoromethyl)benzonitrile;Benzonitrile, 4-(4,4-dimethyl-2,5-dioxo-1-imidazolidinyl)-2-(trifluoromethyl)-;6PAG4TC385;CHEMBL146858;4-(4,4-Dimethyl-2,5-dioxo-1-imidazolidinyl)-2-(trifluoromethyl)benzonitrile;RU-56279;cyano-nilutamide;UNII-6PAG4TC385;SCHEMBL629858;DTXSID901143349;AMY39161;BCP20553;BDBM50135908;MFCD19689673;BS-15392;CS-0006968;D82293;A909682;4-(4,4-Dimethyl-2,5-dioxo-1-imidazolidinyl)-2-trifluoromethyl-benzonitrile;2-(Trifluoromethyl)-4-(2,5-dioxo-4,4-dimethyl-1-imidazolidinyl)benzonitrile;4-(4,4-dimethyl 2,5-dioxo 1-imidazolidinyl) 2-(trifluoromethyl) benzonitrile;4-(4,4-dimethyl-2,5-dioxo-1-imidazolidinyl)-2-(trifluoromethyl)-benzonitril;4-(4,4-dimethyl-2,5-dioxo-1-imidazolidinyl)-2-(trifluoromethyl)-benzonitrile;4-(4,4-Dimethyl-2,5-dioxo-imidazolidin-1-yl)-2-triflouromethyl-benzonitrile;4-(4,4-Dimethyl-2,5-dioxo-imidazolidin-1-yl)-2-trifluoromethyl-benzonitrile

Suppliers and Price of 4-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)-2-trifluoromethylbenzonitrile

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

TRC
4-(4,4-Dimethyl-2,5-dioxo-1-imidazolidinyl)-2-(trifluoromethyl)benzonitrile
100mg
$ 380.00

Chemenu
4-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-2-(trifluoromethyl)benzonitrile 95%
5g
$ 1066.00

Chemenu
4-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-2-(trifluoromethyl)benzonitrile 95%
1g
$ 355.00

Ambeed
4-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)-2-trifluoromethylbenzonitrile 95%
1g
$ 203.00

Ambeed
4-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)-2-trifluoromethylbenzonitrile 95%
250mg
$ 89.00

Total 43 raw suppliers

Chemical Property of 4-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)-2-trifluoromethylbenzonitrile

Chemical Property:

PKA:7.69±0.70(Predicted)
PSA：76.69000
Density:1.46±0.1 g/cm3(Predicted)
LogP:2.11688
Storage Temp.:2-8°C(protect from light)
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:297.07251106
Heavy Atom Count:21
Complexity:521

Purity/Quality:

97% ^*data from raw suppliers

4-(4,4-Dimethyl-2,5-dioxo-1-imidazolidinyl)-2-(trifluoromethyl)benzonitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(C(=O)N(C(=O)N1)C2=CC(=C(C=C2)C#N)C(F)(F)F)C
Uses 4-(4,4-Dimethyl-2,5-dioxo-1-imidazolidinyl)-2-(trifluoromethyl)benzonitrile is an intermediate in the synthesis of Oxo-MDV 3100 (Oxo-enzalutamide) (O857800), which is an impurity of Enzalutamide (M199800), which is an androgen-receptor antagonist that blocks androgens from binding to the androgen receptor and prevents nuclear translocation and co-activator recruitment of the ligand-receptor complex. Enzalutamide has been shown to induce tumor cell apoptosis, and is used for the treatment of castration-resistant prostate cancer.

Technology Process of 4-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)-2-trifluoromethylbenzonitrile

There total 19 articles about 4-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)-2-trifluoromethylbenzonitrile 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: 98.0%

: 101066-87-9
4-iodo-2-(trifluoromethyl)benzonitrile

: 77-71-4
5,5-dimethyl-imidazolidine-2,4-dione

: 143782-20-1
4-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-2-(trifluoromethyl)benzonitrile

Guidance literature:: With copper(I) oxide; In N,N-dimethyl-formamide; at 150 ℃; for 12h;

Reference yield: 95.0%

: 143782-19-8
4-(4,4-Dimethyl-5-imino-2-oxo-1-imidazolidinyl)-2-trifluoromethyl-benzonitrile

: 143782-20-1
4-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-2-(trifluoromethyl)benzonitrile

Guidance literature:: With hydrogenchloride; water; for 0.583333h; Heating / reflux;

Reference yield: 90.0%

: 75-44-5
phosgene

: 654-70-6
4-amino-2-trifluoromethylbenzonitrile

: 84758-81-6
2-amino-isobutyric acid tert-butyl ester hydrochloride

: 143782-20-1
4-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-2-(trifluoromethyl)benzonitrile

Guidance literature:: phosgene; 4-amino-2-trifluoromethylbenzonitrile; In toluene; acetonitrile; at 70 ℃;

2-amino-isobutyric acid tert-butyl ester hydrochloride; With triethylamine; In toluene; acetonitrile; at 20 ℃;

With hydrogenchloride; water; In toluene; acetonitrile; at 70 ℃; for 1h;