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NADH-IN-2

CAT: 0013-GTR19239614-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19239614-03Size:100 mg
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Description
NADH-IN-2 (compound 8) is a potent and selective inhibitor of Type II NADH dehydrogenase (NDH-2) . This small molecule is a valuable research tool for studying mitochondrial function and energy metabolism in both cellular and animal models of infectious diseases and cancer.
CAS Number
67273-56-7
Field of Research
Metabolism Research
Smiles
N=1C=2C=CC=CC2NC1C=3C=CC (=CC3) C (C) C
Molecular Formula
C16H16N2
Molecular Weight
236.31
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-(4-isopropylphenyl)-1H-benzimidazole
CAS Number67273-56-7
PubChem CID735512
IUPAC Name2-(4-propan-2-ylphenyl)-1H-benzimidazole
Molecular FormulaC16H16N2
Molecular Weight236.31
XLogP4.4
Topological Polar Surface Area28.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count18
Formal Charge0
Complexity268
SMILES
CC(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3N2
InChI
InChI=1S/C16H16N2/c1-11(2)12-7-9-13(10-8-12)16-17-14-5-3-4-6-15(14)18-16/h3-11H,1-2H3,(H,17,18)
InChIKey
KZLWMCPIYIDTTK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(4-isopropylphenyl)-1H-benzimidazole
CAS: 67273-56-7
CID: 735512
Formula: C16H16N2
MW: 236.31
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight236.31
XLogP34.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass236.131348519
Monoisotopic Mass236.131348519
Topological Polar Surface Area28.7 Ų
Heavy Atom Count18
Formal Charge0
Complexity268
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