WARNING: This product is for research use only, not for human or veterinary use.
MedKoo CAT#: 530485
CAS#: 1799753-84-6
Description: BAY-876 is a potent and Selective GLUT1 Inhibitor. BAY-876 showed good metabolic stability in vitro and high oral bioavailability in vivo. GLUT1 overexpression has been reported in many types of human cancers, including those of brain,6 breast, colon, kidney, lung, ovary, and prostate, and is correlated with advanced cancer stages and poor clinical outcomes.
MedKoo Cat#: 530485
Name: BAY-876
CAS#: 1799753-84-6
Chemical Formula: C24H16F4N6O2
Exact Mass: 496.1271
Molecular Weight: 496.4256
Elemental Analysis: C, 58.07; H, 3.25; F, 15.31; N, 16.93; O, 6.45
Synonym: BAY-876; BAY 876; BAY876.
IUPAC/Chemical Name: N4-[1-[(4-Cyanophenyl)methyl]-5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-7-fluoro-2,4-Quinolinedicarboxamide
InChi Key: BKLJDIJJOOQUFG-UHFFFAOYSA-N
InChi Code: InChI=1S/C24H16F4N6O2/c1-12-20(21(24(26,27)28)33-34(12)11-14-4-2-13(10-29)3-5-14)32-23(36)17-9-19(22(30)35)31-18-8-15(25)6-7-16(17)18/h2-9H,11H2,1H3,(H2,30,35)(H,32,36)
SMILES Code: O=C(C1=NC2=CC(F)=CC=C2C(C(NC3=C(C)N(CC4=CC=C(C=C4)C#N)N=C3C(F)(F)F)=O)=C1)N
1: Siebeneicher H, Cleve A, Rehwinkel H, Neuhaus R, Heisler I, Müller T, Bauser
M, Buchmann B. Identification and Optimization of the First Highly Selective
GLUT1 Inhibitor BAY-876. ChemMedChem. 2016 Oct 19;11(20):2261-2271. doi:
10.1002/cmdc.201600276. PubMed PMID: 27552707; PubMed Central PMCID: PMC5095872.
