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DKM 2-93

CAT: 1410-M20848-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:1410-M20848-01Size:50 mg
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Description
DKM 2-93 is a relatively selective inhibitor of UBA5 (IC50 : 430 μM) .
CAS Number
65836-72-8
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
243.69
Molecular Formula
C11H14ClNO3
Notes
Research use only, not for human use.
Receptor
UBA5

Chemical Information

Acetamide, 2-chloro-N-((3,4-dimethoxyphenyl)methyl)-
CAS Number65836-72-8
PubChem CID2392259
IUPAC Name2-chloro-N-[(3,4-dimethoxyphenyl)methyl]acetamide
Molecular FormulaC11H14ClNO3
Molecular Weight243.68
XLogP1.2
Topological Polar Surface Area47.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count16
Formal Charge0
Complexity225
SMILES
COC1=C(C=C(C=C1)CNC(=O)CCl)OC
InChI
InChI=1S/C11H14ClNO3/c1-15-9-4-3-8(5-10(9)16-2)7-13-11(14)6-12/h3-5H,6-7H2,1-2H3,(H,13,14)
InChIKey
CETPWRGZGWGPSV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Acetamide, 2-chloro-N-((3,4-dimethoxyphenyl)methyl)-
CAS: 65836-72-8
CID: 2392259
Formula: C11H14ClNO3
MW: 243.68
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight243.68
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass243.0662210
Monoisotopic Mass243.0662210
Topological Polar Surface Area47.6 Ų
Heavy Atom Count16
Formal Charge0
Complexity225
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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