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Tepilamide fumarate

CAT: 1410-M10774-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M10774-01Size:5 mg
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Description
A small-molecule, fumaric acid ester (FAE) compound that is a prodrug of methyl hydrogen fumarate (also known as monomethyl fumarate) .
CAS Number
1208229-58-6
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
243.259
Molecular Formula
C11H17NO5
Notes
Research use only, not for human use.
Receptor
Other Targets

Chemical Information

Tepilamide fumarate
CAS Number1208229-58-6
PubChem CID46179632
IUPAC Name4-O-[2-(diethylamino)-2-oxoethyl] 1-O-methyl (E)-but-2-enedioate
Molecular FormulaC11H17NO5
Molecular Weight243.26
XLogP0.5
Topological Polar Surface Area72.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count17
Formal Charge0
Complexity307
SMILES
CCN(CC)C(=O)COC(=O)/C=C/C(=O)OC
InChI
InChI=1S/C11H17NO5/c1-4-12(5-2)9(13)8-17-11(15)7-6-10(14)16-3/h6-7H,4-5,8H2,1-3H3/b7-6+
InChIKey
AKUGRXRLHCCENI-VOTSOKGWSA-N
Chemical Structure
2D Structure
2D structure of Tepilamide fumarate
CAS: 1208229-58-6
CID: 46179632
Formula: C11H17NO5
MW: 243.26
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight243.26
XLogP30.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass243.11067264
Monoisotopic Mass243.11067264
Topological Polar Surface Area72.9 Ų
Heavy Atom Count17
Formal Charge0
Complexity307
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes