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220036-08-8,MFCD05664735
Catalog No.:AA00C34R

220036-08-8 | NU 6027

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1mg
≥98%
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$46.00   $32.00
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5mg
≥98%
in stock  
$123.00   $86.00
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10mg
≥98%
in stock  
$199.00   $139.00
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50mg
≥98%
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$762.00   $533.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00C34R
Chemical Name:
NU 6027
CAS Number:
220036-08-8
Molecular Formula:
C11H17N5O2
Molecular Weight:
251.2850
MDL Number:
MFCD05664735
SMILES:
O=Nc1c(OCC2CCCCC2)nc(nc1N)N
NSC Number:
707616
Properties
Computed Properties
 
Complexity:
272  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
2.1  

Downstream Synthesis Route

[1]Arris,ChristineE.;Boyle,F.Thomas;Calvert,A.Hilary;Curtin,NicolaJ.;Endicott,JaneA.;Garman,ElspethF.;Gibson,AshleighE.;Golding,BernardT.;Grant,Sharon;Griffin,RogerJ.;Jewsbury,Philip;Johnson,LouiseN.;Lawrie,AlisonM.;Newell,DavidR.;Noble,MartinE.M.;Sausville,EdwardA.;Schultz,Robert;Yu,Wyatt[JournalofMedicinalChemistry,2000,vol.43,#15,p.2797-2804]

[2]CurrentPatentAssignee:CANCERRESEARCHUK-US6677345,2004,B1Locationinpatent:Page/Pagecolumn9-10

[3]Kidwai,Saqib;Bouzeyen,Rania;Chakraborti,Sohini;Khare,Neha;Das,Sumana;Gosain,TannuPriya;Behura,Assirbad;Meena,ChhuttanLal;Dhiman,Rohan;Essafi,Makram;Bajaj,Avinash;Saini,DeepakKumar;Srinivasan,Narayanaswamy;Mahajan,Dinesh;Singh,Ramandeep[AntimicrobialAgentsandChemotherapy,2019,vol.63,#9]

[4]Mesguiche,Veronique;Parsons,RachelJ;Arris,ChristineE;Bentley,Johanne;Boyle,FThomas;Curtin,NicolaJ;Davies,ThomasG;Endicott,JaneA;Gibson,AshleighE;Golding,BernardT;Griffin,RogerJ;Jewsbury,Philip;Johnson,LouiseN;Newell,DavidR;Noble,MartinEM;Wang,LanZ;Hardcastle,IanR[Bioorganicandmedicinalchemistryletters,2003,vol.13,#2,p.217-222]

64-19-7    220036-08-8   
6-acetylamino-2-amino-4-cyclohexylmethoxy-5-nitrosopyrimidine 

[1]Mesguiche,Veronique;Parsons,RachelJ;Arris,ChristineE;Bentley,Johanne;Boyle,FThomas;Curtin,NicolaJ;Davies,ThomasG;Endicott,JaneA;Gibson,AshleighE;Golding,BernardT;Griffin,RogerJ;Jewsbury,Philip;Johnson,LouiseN;Newell,DavidR;Noble,MartinEM;Wang,LanZ;Hardcastle,IanR[Bioorganicandmedicinalchemistryletters,2003,vol.13,#2,p.217-222]

501-53-1    220036-08-8   
(2-amino-6-cyclohexylmethoxy-5-nitroso-pyrimidin-4-yl)-carbamicacidbenzylester 

[1]Mesguiche,Veronique;Parsons,RachelJ;Arris,ChristineE;Bentley,Johanne;Boyle,FThomas;Curtin,NicolaJ;Davies,ThomasG;Endicott,JaneA;Gibson,AshleighE;Golding,BernardT;Griffin,RogerJ;Jewsbury,Philip;Johnson,LouiseN;Newell,DavidR;Noble,MartinEM;Wang,LanZ;Hardcastle,IanR[Bioorganicandmedicinalchemistryletters,2003,vol.13,#2,p.217-222]

79-22-1    220036-08-8   
(2-amino-6-cyclohexylmethoxy-5-nitroso-pyrimidin-4-yl)-carbamicacidmethylester 

[1]Mesguiche,Veronique;Parsons,RachelJ;Arris,ChristineE;Bentley,Johanne;Boyle,FThomas;Curtin,NicolaJ;Davies,ThomasG;Endicott,JaneA;Gibson,AshleighE;Golding,BernardT;Griffin,RogerJ;Jewsbury,Philip;Johnson,LouiseN;Newell,DavidR;Noble,MartinEM;Wang,LanZ;Hardcastle,IanR[Bioorganicandmedicinalchemistryletters,2003,vol.13,#2,p.217-222]

[1]Bioorganicandmedicinalchemistryletters,2003,vol.13,p.217-222

[2]JournalofMedicinalChemistry,2000,vol.43,p.2797-2804

Literature

Title: Repairing of N-mustard derivative BO-1055 induced DNA damage requires NER, HR, and MGMT-dependent DNA repair mechanisms.

Journal: Oncotarget 20150922

Title: Trovafloxacin-induced replication stress sensitizes HepG2 cells to tumor necrosis factor-alpha-induced cytotoxicity mediated by extracellular signal-regulated kinase and ataxia telangiectasia and Rad3-related.

Journal: Toxicology 20150504

Title: Trovafloxacin enhances lipopolysaccharide-stimulated production of tumor necrosis factor-α by macrophages: role of the DNA damage response.

Journal: The Journal of pharmacology and experimental therapeutics 20140701

Title: Modulation of DNA repair by pharmacological inhibitors of the PIKK protein kinase family.

Journal: Bioorganic & medicinal chemistry letters 20120901

Title: A modular approach to trim cellular targets in anticancer drug discovery.

Journal: Bioorganic & medicinal chemistry letters 20111115

Title: Identification and evaluation of a potent novel ATR inhibitor, NU6027, in breast and ovarian cancer cell lines.

Journal: British journal of cancer 20110726

Title: Novel structural features of CDK inhibition revealed by an ab initio computational method combined with dynamic simulations.

Journal: Journal of medicinal chemistry 20060824

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Title: 4-Alkoxy-2,6-diaminopyrimidine derivatives: inhibitors of cyclin dependent kinases 1 and 2.

Journal: Bioorganic & medicinal chemistry letters 20030120

Title: Sustained ER Ca2+ depletion suppresses protein synthesis and induces activation-enhanced cell death in mast cells.

Journal: The Journal of biological chemistry 20020419

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