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Ethopabate-d5

CAT: 0804-HY-W702966-03Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W702966-03Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Ethopabate-d5 (Ethyl pabate-d5) is the deuterium labeled Ethopabate. Ethopabate (Ethyl pabate) is an orally active antiparasitic agent. Ethopabate is often used in combination with Amprolium hydrochloride (HY-B0937A) and others to prevent and treat poultry coccidiosis, leucosis, and other diseases[1][2][3].
CAS Number
2469244-16-2
Product Name Alternative
Ethyl pabate-d5
UNSPSC
12352005
Target
Isotope-Labeled Compounds; Parasite
Related Pathways
Anti-infection; Others
Applications
COVID-19-immunoregulation
Field of Research
Infection
Smiles
[2H]C([2H])(OC1=CC(NC(C)=O)=CC=C1C(OC)=O)C([2H])([2H])[2H]
Molecular Formula
C12H10D5NO4
Molecular Weight
242.28
Shipping Conditions
Room temperature
Scientific Category
Isotope-Labeled Compounds
Clinical Information
No Development Reported

Chemical Information

Ethopabate-d5
CAS Number2469244-16-2
PubChem CID139024061
IUPAC Namemethyl 4-acetamido-2-(1,1,2,2,2-pentadeuterioethoxy)benzoate
Molecular FormulaC12H15NO4
Molecular Weight242.28
XLogP1.2
Topological Polar Surface Area64.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count17
Formal Charge0
Complexity280
SMILES
[2H]C([2H])([2H])C([2H])([2H])OC1=C(C=CC(=C1)NC(=O)C)C(=O)OC
InChI
InChI=1S/C12H15NO4/c1-4-17-11-7-9(13-8(2)14)5-6-10(11)12(15)16-3/h5-7H,4H2,1-3H3,(H,13,14)/i1D3,4D2
InChIKey
GOVWOKSKFSBNGD-SGEUAGPISA-N
Chemical Structure
2D Structure
2D structure of Ethopabate-d5
CAS: 2469244-16-2
CID: 139024061
Formula: C12H15NO4
MW: 242.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight242.28
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass242.13149169
Monoisotopic Mass242.13149169
Topological Polar Surface Area64.6 Ų
Heavy Atom Count17
Formal Charge0
Complexity280
Isotope Atom Count5
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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Alternative Products

CatalogName
MBS6050824-01Ethopabate-d5
TRC-E890800-2.5GEthopabate

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