Home Fluorides 915087-33-1
915087-33-1,MFCD14155804
Catalog No.:AA00GU0F

915087-33-1 | 4-(3-(4-Cyano-3-(trifluoromethyl)phenyl)-5,5-dimethyl-4-oxo-2-thioxoimidazolidin-1-yl)-2-fluoro-n-methylbenzamide

Pack Size
Purity
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Price(USD)
Quantity
  
1mg
98%
in stock  
$6.00   $4.00
- +
5mg
98%
in stock  
$7.00   $5.00
- +
10mg
98%
in stock  
$9.00   $7.00
- +
25mg
98%
in stock  
$12.00   $8.00
- +
50mg
98%
in stock  
$14.00   $10.00
- +
100mg
98%
in stock  
$18.00   $13.00
- +
250mg
98%
in stock  
$23.00   $16.00
- +
1g
98%
in stock  
$85.00   $60.00
- +
5g
98%
in stock  
$207.00   $145.00
- +
25g
98%
in stock  
$725.00   $507.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00GU0F
Chemical Name:
4-(3-(4-Cyano-3-(trifluoromethyl)phenyl)-5,5-dimethyl-4-oxo-2-thioxoimidazolidin-1-yl)-2-fluoro-n-methylbenzamide
CAS Number:
915087-33-1
Molecular Formula:
C21H16F4N4O2S
Molecular Weight:
464.4360
MDL Number:
MFCD14155804
SMILES:
CNC(=O)c1ccc(cc1F)N1C(=S)N(C(=O)C1(C)C)c1ccc(c(c1)C(F)(F)F)C#N
Properties
Computed Properties
 
Complexity:
839  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
3.6  

Downstream Synthesis Route

[1]CurrentPatentAssignee:UNIVERSITYOFCALIFORNIA-US2007/254933,2007,A1Locationinpatent:Page/Pagecolumn7

[2]CurrentPatentAssignee:JIANGSUMINGTAIINVESTMENTGROUPLTD-CN105461634,2016,ALocationinpatent:Paragraph0055;0056

[3]CurrentPatentAssignee:HINOVAPHARMACEUTICAL-EP2792674,2014,A1Locationinpatent:Paragraph0092;0093

[4]CurrentPatentAssignee:LAURUSLABSLIMITED-WO2016/51423,2016,A2Locationinpatent:Page/Pagecolumn29;30;31

[5]CurrentPatentAssignee:VIATRISINC-WO2016/38560,2016,A1Locationinpatent:Page/Pagecolumn10

[6]CurrentPatentAssignee:BEIJINGMEIBEITAPHARMACEUTICALRES-CN109422725,2019,ALocationinpatent:Paragraph0056-0058

C21H17F4N5OS 
  915087-33-1 

[1]CurrentPatentAssignee:UNIVERSITYOFCALIFORNIA-WO2006/124118,2006,A1Locationinpatent:Page/Pagecolumn80

[2]Locationinpatent:experimentalpartJung,MichaelE.;Ouk,Samedy;Yoo,Dongwon;Sawyers,CharlesL.;Chen,Charlie;Tran,Chris;Wongvipat,John[JournalofMedicinalChemistry,2010,vol.53,#7,p.2779-2796]

[1]CurrentPatentAssignee:PFIZERINC-WO2010/99238,2010,A1Locationinpatent:Page/Pagecolumn35-36

[1]Han,Xin;Wang,Chao;Qin,Chong;Xiang,Weiguo;Fernandez-Salas,Ester;Yang,Chao-Yie;Wang,Mi;Zhao,Lijie;Xu,Tianfeng;Chinnaswamy,Krishnapriya;Delproposto,James;Stuckey,Jeanne;Wang,Shaomeng[JournalofMedicinalChemistry,2019,vol.62,#2,p.941-964]

[2]CurrentPatentAssignee:UNIVERSITYOFMICHIGAN-WO2020/142228,2020,A1Locationinpatent:Paragraph0173;0183

[3]CurrentPatentAssignee:PFIZERINC-WO2010/99238,2010,A1Locationinpatent:Page/Pagecolumn32

[4]CurrentPatentAssignee:PFIZERINC-WO2011/106570,2011,A1Locationinpatent:Page/Pagecolumn46

[1]CurrentPatentAssignee:PFIZERINC-WO2011/106570,2011,A1Locationinpatent:Page/Pagecolumn48

[2]CurrentPatentAssignee:JIANGSUMINGTAIINVESTMENTGROUPLTD-CN105461634,2016,ALocationinpatent:Paragraph0063

Literature

Title: Enzalutamide in Men with Nonmetastatic, Castration-Resistant Prostate Cancer.

Journal: The New England journal of medicine 20180628

Title: Iminoenamine based novel androgen receptor antagonist exhibited anti-prostate cancer activity in androgen independent prostate cancer cells through inhibition of AKT pathway.

Journal: Chemico-biological interactions 20170925

Title: LncRNA HOTAIR Enhances the Androgen-Receptor-Mediated Transcriptional Program and Drives Castration-Resistant Prostate Cancer.

Journal: Cell reports 20151006

Title: Niclosamide suppresses cell migration and invasion in enzalutamide resistant prostate cancer cells via Stat3-AR axis inhibition.

Journal: The Prostate 20150901

Title: Targeting chromatin binding regulation of constitutively active AR variants to overcome prostate cancer resistance to endocrine-based therapies.

Journal: Nucleic acids research 20150713

Title: Enzalutamide in metastatic prostate cancer before chemotherapy.

Journal: The New England journal of medicine 20140731

Title: Niclosamide inhibits androgen receptor variants expression and overcomes enzalutamide resistance in castration-resistant prostate cancer.

Journal: Clinical cancer research : an official journal of the American Association for Cancer Research 20140615

Title: Therapeutic targeting of BET bromodomain proteins in castration-resistant prostate cancer.

Journal: Nature 20140612

Title: Molecular alterations and emerging targets in castration resistant prostate cancer.

Journal: European journal of cancer (Oxford, England : 1990) 20140301

Title: Changing paradigms in management of metastatic Castration Resistant Prostate Cancer (mCRPC).

Journal: BMC urology 20140101

Title: NF-κB2/p52 induces resistance to enzalutamide in prostate cancer: role of androgen receptor and its variants.

Journal: Molecular cancer therapeutics 20130801

Title: Identification of potent Yes1 kinase inhibitors using a library screening approach.

Journal: Bioorganic & medicinal chemistry letters 20130801

Title: Androgen receptor promotes ligand-independent prostate cancer progression through c-Myc upregulation.

Journal: PloS one 20130101

Title: Management of docetaxel failures in metastatic castrate-resistant prostate cancer.

Journal: The Urologic clinics of North America 20121101

Title: Increased survival with enzalutamide in prostate cancer after chemotherapy.

Journal: The New England journal of medicine 20120927

Title: Enzalutamide--a major advance in the treatment of metastatic prostate cancer.

Journal: The New England journal of medicine 20120927

Title: Optimizing the care of patients with advanced prostate cancer in the UK: current challenges and future opportunities.

Journal: BJU international 20120901

Title: Urologists and oncologists: adapting to a new treatment paradigm in castration-resistant prostate cancer (CRPC).

Journal: BJU international 20120801

Title: Distinct transcriptional programs mediated by the ligand-dependent full-length androgen receptor and its splice variants in castration-resistant prostate cancer.

Journal: Cancer research 20120715

Title: Novel molecular targets for the therapy of castration-resistant prostate cancer.

Journal: European urology 20120501

Title: The evolving paradigm of second-line hormonal therapy options for castration-resistant prostate cancer.

Journal: Current opinion in oncology 20120501

Title: Interactions of abiraterone, eplerenone, and prednisolone with wild-type and mutant androgen receptor: a rationale for increasing abiraterone exposure or combining with MDV3100.

Journal: Cancer research 20120501

Title: Beyond castration-defining future directions in the hormonal treatment of prostate cancer.

Journal: Hormones & cancer 20120401

Title: ARN-509: a novel antiandrogen for prostate cancer treatment.

Journal: Cancer research 20120315

Title: MDV3100 for the treatment of prostate cancer.

Journal: Expert opinion on investigational drugs 20120201

Title: The evolution of antiandrogens: MDV3100 comes of age.

Journal: Expert review of anticancer therapy 20120201

Title: Novel therapies for metastatic castrate-resistant prostate cancer.

Journal: Journal of the National Cancer Institute 20111116

Title: Inhibitors of androgen receptor activation function-2 (AF2) site identified through virtual screening.

Journal: Journal of medicinal chemistry 20110922

Title: Current clinical trials in castrate-resistant prostate cancer.

Journal: Current urology reports 20110601

Title: [The trend toward development of novel agents based on the mechanism of prostate cancer progression].

Journal: Nihon rinsho. Japanese journal of clinical medicine 20110601

Title: Changing therapeutic paradigms in castrate-resistant prostate cancer.

Journal: Clinical genitourinary cancer 20101201

Title: A renaissance in the medical treatment of advanced prostate cancer.

Journal: Oncology (Williston Park, N.Y.) 20101201

Title: Revisiting the ultimate target of treatment for prostate cancer.

Journal: Lancet (London, England) 20100424

Title: Antitumour activity of MDV3100 in castration-resistant prostate cancer: a phase 1-2 study.

Journal: Lancet (London, England) 20100424

Title: Structure-activity relationship for thiohydantoin androgen receptor antagonists for castration-resistant prostate cancer (CRPC).

Journal: Journal of medicinal chemistry 20100408

Title: [Androgen-deprivation therapy in prostate cancer: clinical evidence and future perspectives].

Journal: Urologia 20100101

Title: Steroid hormone receptors in prostate cancer: a hard habit to break?

Journal: Cancer cell 20091208

Title: Beyond castration and chemotherapy: novel approaches to targeting androgen-driven pathways.

Journal: Maturitas 20091020

Title: New therapeutic agents for castration-refractory prostate cancer.

Journal: Clinical genitourinary cancer 20090801

Title: Development of androgen receptor antagonists with promising activity in castration-resistant prostate cancer.

Journal: Cancer cell 20090602

Title: Development of a second-generation antiandrogen for treatment of advanced prostate cancer.

Journal: Science (New York, N.Y.) 20090508

Title: Drug development. New way to target hormone receptor thwarts prostate cancer.

Journal: Science (New York, N.Y.) 20090410

Title: Tran C, et al. Development of a second-generation antiandrogen for treatment of advanced prostate cancer. Science, 2009, 324 (5928), 787-790.

Title: Scher HI, et al. Antitumour activity of MDV3100 in castration-resistant prostate cancer: a phase 1-2 study. Lancet, 2010, 375(9724), 1437-1446.

Title: Guerrero J, et al. Enzalutamide, an androgen receptor signaling inhibitor, induces tumor regression in a mouse model of castration-resistant prostate cancer. Prostate. 2013 Sep;73(12):1291-305.

Title: Kim TH, et al. Pharmacokinetics of enzalutamide, an anti-prostate cancer drug, in rats. Arch Pharm Res. 2015 Nov;38(11):2076-82.

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Tags:915087-33-1 Molecular Formula|915087-33-1 MDL|915087-33-1 SMILES|915087-33-1 4-(3-(4-Cyano-3-(trifluoromethyl)phenyl)-5,5-dimethyl-4-oxo-2-thioxoimidazolidin-1-yl)-2-fluoro-n-methylbenzamide