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JFD00950

CAT: 0013-GTR19211528-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19211528-03Size:100 mg
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Description
JFD00950 is a small molecule inhibitor of human flap endonuclease 1 (FEN1) . It demonstrates in vitro inhibition of FEN1's flap cleavage activity and exhibits cytotoxic effects against the DLD-1 colon cancer cell line, making it a useful tool for studying DNA replication and repair mechanisms in cancer research.
CAS Number
882278-66-2
Smiles
O=C1C=2C (C (=O) C (Cl) =C1OC3=C (Cl) C=C (Cl) C (Cl) =C3) =CC=CC2
Molecular Formula
C16H6Cl4O3
Molecular Weight
388.03
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-Chloro-3-(2,4,5-trichlorophenoxy)naphthalene-1,4-dione
CAS Number882278-66-2
PubChem CID2817456
IUPAC Name2-chloro-3-(2,4,5-trichlorophenoxy)naphthalene-1,4-dione
Molecular FormulaC16H6Cl4O3
Molecular Weight388.0
XLogP5.9
Topological Polar Surface Area43.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count23
Formal Charge0
Complexity547
SMILES
C1=CC=C2C(=C1)C(=O)C(=C(C2=O)Cl)OC3=CC(=C(C=C3Cl)Cl)Cl
InChI
InChI=1S/C16H6Cl4O3/c17-9-5-11(19)12(6-10(9)18)23-16-13(20)14(21)7-3-1-2-4-8(7)15(16)22/h1-6H
InChIKey
ZFBYNRLQXMCZPT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Chloro-3-(2,4,5-trichlorophenoxy)naphthalene-1,4-dione
CAS: 882278-66-2
CID: 2817456
Formula: C16H6Cl4O3
MW: 388.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight388.0
XLogP35.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass387.904155
Monoisotopic Mass385.907105
Topological Polar Surface Area43.4 Ų
Heavy Atom Count23
Formal Charge0
Complexity547
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

Alternative Products

CatalogName
T68449-01JFD00950

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