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TMX-4100

CAT: 0804-HY-145321-06Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-145321-06Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
TMX-4100 is a selective phosphodiesterase 6D (PDE6D) degrader. TMX-4100 shows a high degradation preference for PDE6D with the DC50 values less than 200 nM in MOLT4, Jurkat, and MM.1S cells. TMX-4100 can be used for the research of multiple myeloma[1].
CAS Number
2367619-63-2
UNSPSC
12352005
Target
Molecular Glues; Phosphodiesterase (PDE)
Type
Reference compound
Related Pathways
Metabolic Enzyme/Protease; PROTAC
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/tmx-4100.html
Purity
98.18
Solubility
DMSO : 100 mg/mL (ultrasonic; warming; heat to 60°C)
Smiles
O=C(C(N1N=NC(C2=CSC=C2)=C1)CC3)NC3=O
Molecular Formula
C11H10N4O2S
Molecular Weight
262.29
References & Citations
[1]Teng M, et al. Development of PDE6D and CK1α Degraders through Chemical Derivatization of FPFT-2216. J Med Chem. 2022 Jan 13;65 (1) :747-756.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
PDE6

Chemical Information

CID 151449452
CAS Number2367619-63-2
PubChem CID151449452
IUPAC Name3-(4-thiophen-3-yltriazol-1-yl)piperidine-2,6-dione
Molecular FormulaC11H10N4O2S
Molecular Weight262.29
XLogP0.4
Topological Polar Surface Area105
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count18
Formal Charge0
Complexity365
SMILES
C1CC(=O)NC(=O)C1N2C=C(N=N2)C3=CSC=C3
InChI
InChI=1S/C11H10N4O2S/c16-10-2-1-9(11(17)12-10)15-5-8(13-14-15)7-3-4-18-6-7/h3-6,9H,1-2H2,(H,12,16,17)
InChIKey
PGEUBQZQGXWTFO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of CID 151449452
CAS: 2367619-63-2
CID: 151449452
Formula: C11H10N4O2S
MW: 262.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight262.29
XLogP30.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass262.05244675
Monoisotopic Mass262.05244675
Topological Polar Surface Area105 Ų
Heavy Atom Count18
Formal Charge0
Complexity365
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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