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Nampt-IN-16

CAT: 0931-T210565-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T210565-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3077970-44-3
Target
Apoptosis, NAMPT
Related Pathways
Metabolism, Apoptosis
Bioactivity
Nampt-IN-16 (Compound 9a) is an orally active NAMPT inhibitor with an IC50 of 0.15 μM. It reduces intracellular NAD+ and ATP levels. Nampt-IN-16 inhibits the proliferation, migration, and invasion of gastric cancer cells, induces cell cycle arrest and apoptosis, and alters cellular metabolism. This compound is applicable for research in tumors such as gastric cancer.
Smiles
O=C(OCC=1C=NC=CC1)NC2=CC=C(C=C2)CNC(=O)C3=CC(F)=CC=C3N4CCCC4
Molecular Formula
C25H25FN4O3
Molecular Weight
448.49
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Nampt-IN-16
CAS Number3077970-44-3
PubChem CID176514760
IUPAC Namepyridin-3-ylmethyl N-[4-[[(5-fluoro-2-pyrrolidin-1-ylbenzoyl)amino]methyl]phenyl]carbamate
Molecular FormulaC25H25FN4O3
Molecular Weight448.5
XLogP3.4
Topological Polar Surface Area83.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count33
Formal Charge0
Complexity637
SMILES
C1CCN(C1)C2=C(C=C(C=C2)F)C(=O)NCC3=CC=C(C=C3)NC(=O)OCC4=CN=CC=C4
InChI
InChI=1S/C25H25FN4O3/c26-20-7-10-23(30-12-1-2-13-30)22(14-20)24(31)28-16-18-5-8-21(9-6-18)29-25(32)33-17-19-4-3-11-27-15-19/h3-11,14-15H,1-2,12-13,16-17H2,(H,28,31)(H,29,32)
InChIKey
ULMUOHYPKGDIMQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Nampt-IN-16
CAS: 3077970-44-3
CID: 176514760
Formula: C25H25FN4O3
MW: 448.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight448.5
XLogP33.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass448.19106883
Monoisotopic Mass448.19106883
Topological Polar Surface Area83.6 Ų
Heavy Atom Count33
Formal Charge0
Complexity637
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

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