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FIN56

CAT: 0957-S8254-02Size: 10 mm/ 1 mLDry Ice: YesHazardous: No
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CAT#:0957-S8254-02Size:10 mm/ 1 mL
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Description
FIN56 is a specific inducer of ferroptosis .
CAS Number
1083162-61-1
Target
Ferroptosis
Activity
Apoptosis
Molecular Formula
C25H31N3O5S2
Storage Conditions
2 years -80 in solvent

Chemical Information

Fin56

FIN56 is a fluorene that is N-9H-fluoren-9-ylidenehydroxylamine substituted by N-cyclohexylsulfonyl groups at positions 2 and 7. It induces ferroptosis via degradation of GPX4 and also binds and activates squalene synthase. It has a role as a ferroptosis inducer and an EC 1.11.1.9 (glutathione peroxidase) inhibitor. It is a member of fluorenes, a ketoxime and a sulfonamide. It is functionally related to a 9-hydroxyiminofluorene-2,7-disulfonamide.

CAS Number1083162-61-1
PubChem CID118986699
IUPAC Name2-N,7-N-dicyclohexyl-9-hydroxyiminofluorene-2,7-disulfonamide
Molecular FormulaC25H31N3O5S2
Molecular Weight517.7
XLogP4.9
Topological Polar Surface Area142
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Heavy Atom Count35
Formal Charge0
Complexity900
SMILES
C1CCC(CC1)NS(=O)(=O)C2=CC3=C(C=C2)C4=C(C3=NO)C=C(C=C4)S(=O)(=O)NC5CCCCC5
InChI
InChI=1S/C25H31N3O5S2/c29-26-25-23-15-19(34(30,31)27-17-7-3-1-4-8-17)11-13-21(23)22-14-12-20(16-24(22)25)35(32,33)28-18-9-5-2-6-10-18/h11-18,27-29H,1-10H2
InChIKey
JLCFMMIWBSZOIS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fin56
CAS: 1083162-61-1
CID: 118986699
Formula: C25H31N3O5S2
MW: 517.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight517.7
XLogP34.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Exact Mass517.17051344
Monoisotopic Mass517.17051344
Topological Polar Surface Area142 Ų
Heavy Atom Count35
Formal Charge0
Complexity900
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