Catalog No.:AA00GU35

882531-87-5 | R1530

Name: Name:R1530
Brand: AABLOCKS
SKU: AA00GU35
Rating: 90 (10 reviews)

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Technical Information
Properties
Downstream Synthesis Route
Literature
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Download SDS

Technical Information
Properties
Downstream Synthesis Route
Literature

Technical Information

Catalog Number:

AA00GU35

Chemical Name:

R1530

CAS Number:

882531-87-5

Molecular Formula:

C18H14ClFN4O

Molecular Weight:

356.7814

MDL Number:

MFCD23704870

SMILES:

COc1cc2nc3[nH][nH]c(c3nc(c2cc1F)c1ccccc1Cl)C

Properties

Computed Properties

Complexity:

521

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Rotatable Bond Count:

XLogP3:

4.4

Downstream Synthesis Route

882531-35-3

882531-87-5

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2006/79511,2006,A1Locationinpatent:Page/Pagecolumn42

882531-70-6

882531-87-5

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2006/79511,2006,A1Locationinpatent:Page/Pagecolumn32-33

1178859-08-9

882531-87-5

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2006/79511,2006,A1Locationinpatent:Page/Pagecolumn40-41

1178859-10-3

882531-87-5

[1]CurrentPatentAssignee:INTERNATIONALCHEMICALSINVESTORSSE-US2009/203901,2009,A1Locationinpatent:Page/Pagecolumn32

3863-11-4

882531-87-5

[1]Liu,Jin-Jun;Higgins,Brian;Ju,Grace;Kolinsky,Kenneth;Luk,Kin-Chun;Packman,Kathryn;Pizzolato,Giacomo;Ren,Yi;Thakkar,Kshitij;Tovar,Christian;Zhang,Zhuming;Wovkulich,PeterM.[ACSMedicinalChemistryLetters,2013,vol.4,#2,p.259-263]

[2]Liu,Jin-Jun;Higgins,Brian;Ju,Grace;Kolinsky,Kenneth;Luk,Kin-Chun;Packman,Kathryn;Pizzolato,Giacomo;Ren,Yi;Thakkar,Kshitij;Tovar,Christian;Zhang,Zhuming;Wovkulich,PeterM.[ACSMedicinalChemistryLetters,2013,vol.4,#2,p.259-263]

Literature

Title: Jin-Jun Liu, et al. Discovery of a Highly Potent, Orally Active Mitosis/Angiogenesis Inhibitor R1530 for the Treatment of Solid Tumors. ACS Med Chem Lett. 2013 Feb 14; 4(2): 259–263.

Title: Christian Tovar, et al. Small-molecule inducer of cancer cell polyploidy promotes apoptosis or senescence: Implications for therapy. Cell Cycle. 2010 Aug 15;9(16):3364-75.

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SDS