Products for Research Use Only

KL1333

CAT: 0013-GTR19155682-05Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19155682-05Size:5 mg
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Description
KL1333 enhances energy metabolism and mitochondrial dysfunction in MELAS fibroblasts. Elevated NAD+ levels trigger the activation of SIRT1 and AMPK, and subsequently activates PGC-1α. NQO1 activator 1 is an orally available NAD+ modulator. It reacts with NAD (P) H: NQO1 as a substrate, resulting in increases in intracellular NAD+ levels via NADH oxidation.
CAS Number
1800405-30-4
Product Name Alternative
NQO1 activator 1
Purity
>98% (HPLC)
Solubility
DMSO:245 mg/mL (1019.73 mM; Need ultrasonic)
Smiles
CC (C) c1nc (-c (cccc2) c2C (C2=O) =O) c2[nH]1
Molecular Formula
C14H12N2O2
Molecular Weight
240.26
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Kl-1333
CAS Number1800405-30-4
PubChem CID91820639
IUPAC Name2-propan-2-yl-3H-benzo[e]benzimidazole-4,5-dione
Molecular FormulaC14H12N2O2
Molecular Weight240.26
XLogP2.3
Topological Polar Surface Area62.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count18
Formal Charge0
Complexity380
SMILES
CC(C)C1=NC2=C(N1)C(=O)C(=O)C3=CC=CC=C32
InChI
InChI=1S/C14H12N2O2/c1-7(2)14-15-10-8-5-3-4-6-9(8)12(17)13(18)11(10)16-14/h3-7H,1-2H3,(H,15,16)
InChIKey
AJFWITSBVLLDCC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Kl-1333
CAS: 1800405-30-4
CID: 91820639
Formula: C14H12N2O2
MW: 240.26
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight240.26
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass240.089877630
Monoisotopic Mass240.089877630
Topological Polar Surface Area62.8 Ų
Heavy Atom Count18
Formal Charge0
Complexity380
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes