Products for Research Use Only

Rac-Ambrisentan-d3

CAT: 1459-CS-O-06398Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-O-06398Size:1 Each
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Description
Rac-Ambrisentan-d3 is listed under Stable Isotopes and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Ambrisentan. The product is supplied by Clearsynth under CAT No. CS-O-06398. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
"Labeled Ambrisentan, intended for use as an internal standard for the quantification of Ambrisentan by GC- or LC-mass spectrometry."
CAS Number
1189479-60-4
Synonyms
Rac-Ambrisentan-d3
Molecular Formula
C 22 H 19 D 3 N 2 O 4
Molecular Weight
381.44
Additionnal Information
Rac-Ambrisentan-d3 is supplied with detailed characterization data compliant with regulatory guideline. rac-Ambrisentan-d3 can be used for analytical method development, method validation (AMV), Quality Control (QC) application for Abbreviated New Drug Application (ANDA), or during commercial production of Ambrisentan.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
"Labeled Ambrisentan, intended for use as an internal standard for the quantification of Ambrisentan by GC- or LC-mass spectrometry."
HSN Code
38229010
Hazard Compound
Refer MSDS for accurate information.

Chemical Information

rac Ambrisentan-d3
CAS Number1189479-60-4
PubChem CID46780134
IUPAC Name2-(4,6-dimethylpyrimidin-2-yl)oxy-3,3-diphenyl-3-(trideuteriomethoxy)propanoic acid
Molecular FormulaC22H22N2O4
Molecular Weight381.4
XLogP3.8
Topological Polar Surface Area81.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count28
Formal Charge0
Complexity475
SMILES
[2H]C([2H])([2H])OC(C1=CC=CC=C1)(C2=CC=CC=C2)C(C(=O)O)OC3=NC(=CC(=N3)C)C
InChI
InChI=1S/C22H22N2O4/c1-15-14-16(2)24-21(23-15)28-19(20(25)26)22(27-3,17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-14,19H,1-3H3,(H,25,26)/i3D3
InChIKey
OUJTZYPIHDYQMC-HPRDVNIFSA-N
Chemical Structure
2D Structure
2D structure of rac Ambrisentan-d3
CAS: 1189479-60-4
CID: 46780134
Formula: C22H22N2O4
MW: 381.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight381.4
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass381.17678743
Monoisotopic Mass381.17678743
Topological Polar Surface Area81.5 Ų
Heavy Atom Count28
Formal Charge0
Complexity475
Isotope Atom Count3
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes