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Imexon

CAT: 0931-T15566-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T15566-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
59643-91-3
Target
Others
Related Pathways
Others
Bioactivity
Imexon is an iminopyrrolidone aziridine. It has anti-cancer activity.
Smiles
NC=1C2N(C2)C(=O)N1
Molecular Formula
C4H5N3O
Molecular Weight
111.1
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Imexon

Imexon is currently being studied for the treatment of pancreatic, lung, breast, prostate, melanoma, and multiple myeloma cancers. It belongs to the family of drugs called cyanoaziridine derivatives. Also called Amplimexon. Imexon is a cyanoaziridine derivative. Imexon is a thiol-binding small molecule which induces mitochondrial oxidation, a loss of membrane potential and cytochrome C, leading to apoptosis.

CAS Number59643-91-3
PubChem CID68791
IUPAC Name4-amino-1,3-diazabicyclo[3.1.0]hex-3-en-2-one
Molecular FormulaC4H5N3O
Molecular Weight111.10
XLogP-1.4
Topological Polar Surface Area58.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity186
SMILES
C1C2N1C(=O)N=C2N
InChI
InChI=1S/C4H5N3O/c5-3-2-1-7(2)4(8)6-3/h2H,1H2,(H2,5,6,8)
InChIKey
BIXBBIPTYBJTRY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Imexon
CAS: 59643-91-3
CID: 68791
Formula: C4H5N3O
MW: 111.10
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight111.10
XLogP3-1.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass111.043261792
Monoisotopic Mass111.043261792
Topological Polar Surface Area58.5 Ų
Heavy Atom Count8
Formal Charge0
Complexity186
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