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Fast-TRFS

CAT: 0931-T86410-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T86410-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2966536-18-3
Target
Others
Related Pathways
Others
Bioactivity
Fast-TRFS, a selective and superfast fluorogenic probe of thioredoxin reductase (TrxR), can be utilized for imaging TrxR activity in live cells [1].
Smiles
C(F)(F)(F)C=1C=2C(=CC(NC(NC3CSSC3)=O)=CC2)OC(=O)C1
Molecular Formula
C14H11F3N2O3S2
Molecular Weight
376.37
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Fast-TRFS
CAS Number2966536-18-3
PubChem CID146168837
IUPAC Name1-(dithiolan-4-yl)-3-[2-oxo-4-(trifluoromethyl)chromen-7-yl]urea
Molecular FormulaC14H11F3N2O3S2
Molecular Weight376.4
XLogP1.9
Topological Polar Surface Area118
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count2
Heavy Atom Count24
Formal Charge0
Complexity550
SMILES
C1C(CSS1)NC(=O)NC2=CC3=C(C=C2)C(=CC(=O)O3)C(F)(F)F
InChI
InChI=1S/C14H11F3N2O3S2/c15-14(16,17)10-4-12(20)22-11-3-7(1-2-9(10)11)18-13(21)19-8-5-23-24-6-8/h1-4,8H,5-6H2,(H2,18,19,21)
InChIKey
WRYRCLGYENFDIB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fast-TRFS
CAS: 2966536-18-3
CID: 146168837
Formula: C14H11F3N2O3S2
MW: 376.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight376.4
XLogP31.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count2
Exact Mass376.01631905
Monoisotopic Mass376.01631905
Topological Polar Surface Area118 Ų
Heavy Atom Count24
Formal Charge0
Complexity550
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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