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N6F11

CAT: 0957-E1812-50mgSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0957-E1812-50mgSize:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
851398-76-0
Target
Ferroptosis
Applications
Apoptosis
Molecular Formula
C13H8Cl2N2OS
Additionnal Information
N6F11 is an inducer of ferroptosis. N6F11 is bound to the RING domain of the E3 ubiquitin ligase tripartite motif containing 25 (TRIM25) in cancer cells to trigger TRIM25-mediated K48-linked ubiquitination of glutathione peroxidase 4 (GPX4), resulting in proteasomal degradation.

Chemical Information

2-(chloromethyl)-6-(4-chlorophenyl)-3H,4H-thieno[3,2-d]pyrimidin-4-one
CAS Number851398-76-0
PubChem CID135490253
IUPAC Name2-(chloromethyl)-6-(4-chlorophenyl)-3H-thieno[3,2-d]pyrimidin-4-one
Molecular FormulaC13H8Cl2N2OS
Molecular Weight311.2
XLogP3.6
Topological Polar Surface Area69.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count19
Formal Charge0
Complexity396
SMILES
C1=CC(=CC=C1C2=CC3=C(S2)C(=O)NC(=N3)CCl)Cl
InChI
InChI=1S/C13H8Cl2N2OS/c14-6-11-16-9-5-10(19-12(9)13(18)17-11)7-1-3-8(15)4-2-7/h1-5H,6H2,(H,16,17,18)
InChIKey
KXALOVOFOCKYSD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(chloromethyl)-6-(4-chlorophenyl)-3H,4H-thieno[3,2-d]pyrimidin-4-one
CAS: 851398-76-0
CID: 135490253
Formula: C13H8Cl2N2OS
MW: 311.2
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight311.2
XLogP33.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass309.9734394
Monoisotopic Mass309.9734394
Topological Polar Surface Area69.7 Ų
Heavy Atom Count19
Formal Charge0
Complexity396
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
GTR19213751-01N6F11

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