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NPD4928

CAT: 0013-GTR19211641-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19211641-02Size:50 mg
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Description
NPD4928 is a research compound that sensitizes diverse cancer cell lines to GPX4 inhibitors, promoting ferroptosis. This combination has shown potential in preclinical in vitro studies for oncology research, particularly in investigating iron-dependent cell death pathways as a therapeutic strategy.
CAS Number
956965-61-0
Field of Research
Cell Biology, Metabolism Research
Smiles
O (CC (NCCC=1C=2C (NC1) =CC=C (OC) C2) =O) C=3C4=C (C5=C (C3) OC (C) (C) CC5) OC (=O) C (C) =C4C
Molecular Formula
C29H32N2O6
Molecular Weight
504.57
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-(2-(5-methoxy-1H-indol-3-yl)ethyl)-2-((3,4,8,8-tetramethyl-2-oxo-2,8,9,10-tetrahydropyrano[2,3-f]chromen-5-yl)oxy)acetamide
CAS Number956965-61-0
PubChem CID16406972
IUPAC NameN-[2-(5-methoxy-1H-indol-3-yl)ethyl]-2-[(3,4,8,8-tetramethyl-2-oxo-9,10-dihydropyrano[2,3-h]chromen-5-yl)oxy]acetamide
Molecular FormulaC29H32N2O6
Molecular Weight504.6
XLogP4.5
Topological Polar Surface Area98.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count37
Formal Charge0
Complexity903
SMILES
CC1=C(C(=O)OC2=C3CCC(OC3=CC(=C12)OCC(=O)NCCC4=CNC5=C4C=C(C=C5)OC)(C)C)C
InChI
InChI=1S/C29H32N2O6/c1-16-17(2)28(33)36-27-20-8-10-29(3,4)37-23(20)13-24(26(16)27)35-15-25(32)30-11-9-18-14-31-22-7-6-19(34-5)12-21(18)22/h6-7,12-14,31H,8-11,15H2,1-5H3,(H,30,32)
InChIKey
ZDCXTKTVNQLRGC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2-(5-methoxy-1H-indol-3-yl)ethyl)-2-((3,4,8,8-tetramethyl-2-oxo-2,8,9,10-tetrahydropyrano[2,3-f]chromen-5-yl)oxy)acetamide
CAS: 956965-61-0
CID: 16406972
Formula: C29H32N2O6
MW: 504.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight504.6
XLogP34.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass504.22603674
Monoisotopic Mass504.22603674
Topological Polar Surface Area98.9 Ų
Heavy Atom Count37
Formal Charge0
Complexity903
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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