CC-115
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MedKoo CAT#: 205829

CAS#: 1228013-15-7 (free base)

Description: CC-115 is a dual inhibitor of DNA-dependent protein kinase (DNA-PK) and mammalian target of rapamycin (mTOR), with potential antineoplastic activity. CC-115 binds to and inhibits the activity of DNA-PK and both raptor-mTOR (TOR complex 1 or TORC1) and rictor-mTOR (TOR complex 2 or TORC2), which may lead to a reduction in cellular proliferation of cancer cells expressing DNA-PK and TOR. DNA-PK, a serine/threonine kinase and a member of the PI3K-related kinase subfamily of protein kinases, is activated upon DNA damage and plays a key role in repairing double-stranded DNA breaks via the DNA nonhomologous end joining (NHEJ) pathway.


Price and Availability

Size
Price

10mg
USD 150
100mg
USD 750
1g
USD 3250
Size
Price

25mg
USD 250
200mg
USD 1250
2g
USD 4250
Size
Price

50mg
USD 450
500mg
USD 1950
5g
USD 6750

CC-115, purity > 98%, is in stock. The same day shipping out after order is received. Note: the estimated shipping out time for order >800mg may be 2 weeks.


Chemical Structure

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Theoretical Analysis

MedKoo Cat#: 205829
Name: CC-115
CAS#: 1228013-15-7 (free base)
Chemical Formula: C16H16N8O
Exact Mass: 336.14471
Molecular Weight: 336.14
Elemental Analysis: C, 57.13; H, 4.79; N, 33.31; O, 4.76


Related CAS #: 1228013-15-7 (free base)   1300118-55-1 (HCl)    

Synonym: CC115 ; CC-115; CC 115.

IUPAC/Chemical Name: 1-ethyl-7-(2-methyl-6-(1H-1,2,4-triazol-5-yl)pyridin-3-yl)-3,4-dihydropyrazino[2,3-b]pyrazin-2(1H)-one

InChi Key: GMYLVKUGJMYTFB-UHFFFAOYSA-N

InChi Code: InChI=1S/C16H16N8O/c1-3-24-13(25)7-18-15-16(24)22-12(6-17-15)10-4-5-11(21-9(10)2)14-19-8-20-23-14/h4-6,8H,3,7H2,1-2H3,(H,17,18)(H,19,20,23)

SMILES Code: O=C1CNC2=NC=C(C3=CC=C(C4=NC=NN4)N=C3C)N=C2N1CC


Technical Data

Appearance:
Red Solid powder

Purity:
>98% (or refer to the Certificate of Analysis)

Certificate of Analysis:

Safety Data Sheet (MSDS):

Shipping Condition:
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.

Storage Condition:
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).

Solubility:
Soluble in DMSO, not in water

Shelf Life:
>5 years if stored properly

Drug Formulation:
This drug may be formulated in DMSO

Stock Solution Storage:
0 - 4 C for short term (days to weeks), or -20 C for long term (months).

Harmonized System Code:
293490


Additional Information

Related CAS#
CAS#1228013-15-7 (CC-115 free base);
CAS#1300118-55-1 (CC-115 .xHCl salt)
 
 
 


References

1: Thijssen R, Ter Burg J, Garrick B, van Bochove GG, Brown JR, Fernandes SM, Rodríguez MS, Michot JM, Hallek M, Eichhorst B, Reinhardt HC, Bendell J, Derks IA, van Kampen RJ, Hege K, Kersten MJ, Trowe T, Filvaroff EH, Eldering E, Kater AP. Dual TORK/DNA-PK inhibition blocks critical signaling pathways in chronic lymphocytic leukemia. Blood. 2016 Jul 28;128(4):574-83. doi: 10.1182/blood-2016-02-700328. Epub 2016 May 27. PubMed PMID: 27235137.

2: Mortensen DS, Perrin-Ninkovic SM, Shevlin G, Elsner J, Zhao J, Whitefield B, Tehrani L, Sapienza J, Riggs JR, Parnes JS, Papa P, Packard G, Lee BG, Harris R, Correa M, Bahmanyar S, Richardson SJ, Peng SX, Leisten J, Khambatta G, Hickman M, Gamez JC, Bisonette RR, Apuy J, Cathers BE, Canan SS, Moghaddam MF, Raymon HK, Worland P, Narla RK, Fultz KE, Sankar S. Optimization of a Series of Triazole Containing Mammalian Target of Rapamycin (mTOR) Kinase Inhibitors and the Discovery of CC-115. J Med Chem. 2015 Jul 23;58(14):5599-608. doi: 10.1021/acs.jmedchem.5b00627. Epub 2015 Jul 8. PubMed PMID: 26102506.

3: Saiz C, Wipf P, Manta E, Mahler G. Reversible thiazolidine exchange: a new reaction suitable for dynamic combinatorial chemistry. Org Lett. 2009 Aug 6;11(15):3170-3. doi: 10.1021/ol901104a. Erratum in: Org Lett. 2010 Jul 16;12(14):3284. PubMed PMID: 19585999; PubMed Central PMCID: PMC2736333.

4: Warheit DB, Hartsky MA, McHugh TA, Kellar KA. Biopersistence of inhaled organic and inorganic fibers in the lungs of rats. Environ Health Perspect. 1994 Oct;102 Suppl 5:151-7. PubMed PMID: 7882921; PubMed Central PMCID: PMC1567301.