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cct245737-s-isomer

cct245737-s-isomer

Item no.	V2735-10mg
Manufacturer	InvivoChem LLC
CASRN	1489389-23-2
Amount	10mg
Category	Reagents & Chemicals Molecules
Type	Biochemicals
Specific against	other
ECLASS 10.1	32160490
ECLASS 11.0	32160490
UNSPSC	12000000
Available
Description	InvivoChem Cat #:V2735CAS #:1489389-23-2 Purity >=98% Description: CCT245737 S-enantiomer, the S-isomer of CCT245737, is a novel, potent, orally available and selective ATP-competitive inhibitor of CHK1 (checkpoint kinase 1) with an IC50 of 30-220 nM. It shows< 50% 10='' 121='' inhibition='' at='' m='' for='' representing='' a='' selectivity='' chk1='' of=''> 5000-fold over these enzymes. CCT245737 enhanced gemcitabine antitumor activity to a greater degree than for higher doses of either agent alone, without increasing toxicity. CCT2457374 shows an increase in plasma and tumoconcentrations between 3-100 mg/kg. CCT245737 has low predicted doses and exposures in humans which mitigated the residual weak in vitro hERG inhibition. References: Oncotarget. 2016 Jan 19; 7(3):2329-42. Related CAS#:1489389-18-5 (CCT245737)
Molecular Weight (MW)	379.34
Formula	C16H16F3N7O
CAS No.	1489389-23-2(S-enantiomer);
Storage	-20C for 3 years in powder form
	-80C for 2 years in solvent
Solubility (In vitro)	DMSO: 75 mg/mL (197.7 mM)
	Water: < 1 mg/mL
	Ethanol: 9 mg/mL (23.7 mM)
SMILES	N#CC1=NC=C(NC2=NC=C(C(F)(F)F)C(NC[CH]3CNCCO3)=C2)N=C1
Synonyms	CCT 245737 S-enantiomer; CCT245737 S-isomer; CCT-245737.

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