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Valsartan methyl ester

CAT: 0804-HY-W414915-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W414915-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Valsartan (CGP 48933) methyl ester is the methyl ester derivative of Valsartan. Valsartan is a selective angiotensin II type 1 (AT1) receptor blocker (ARB) with potent antihypertensive and cardioprotective effects. Valsartan competitively binds to AT1 receptors, inhibiting the binding of angiotensin II to AT1 receptors, thereby blocking angiotensin II-mediated vasoconstriction, sodium retention, and myocardial hypertrophy signaling pathways. Valsartan reduces systolic blood pressure in L-NAME-induced hypertensive rats. Valsartan can be used for the study and treatment of arterial hypertension, hypertensive heart disease, and heart failure[1].
CAS Number
137863-17-3
Product Name Alternative
CGP 48933 methyl ester
UNSPSC
12352005
Hazard Statement
H228, H315, H319
Target
Angiotensin Receptor; Drug Derivative
Type
Reference compound
Related Pathways
GPCR/G Protein; Others
Applications
Neuroscience-Neuromodulation
Field of Research
Cardiovascular Disease
Assay Protocol
https://www.medchemexpress.com/valsartan-methyl-ester.html
Purity
99.39
Solubility
DMSO : 175 mg/mL (ultrasonic)
Smiles
COC([C@H](C(C)C)N(C(CCCC)=O)CC1=CC=C(C=C1)C2=C(C3=NN=NN3)C=CC=C2)=O
Molecular Formula
C25H31N5O3
Molecular Weight
449.55
Precautions
H228, H315, H319
References & Citations
[1]Stanko P, et al. Sacubitril/Valsartan Alleviates Cardiac Remodeling and Dysfunction in L-NAME-Induced Hypertension and Hypertensive Heart Disease.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

N-(1-Oxopentyl)-N-((2'-(2H-tetrazol-5-yl)(1,1'-biphenyl)-4-yl)methyl)-L-valine methyl ester
CAS Number137863-17-3
PubChem CID11561462
IUPAC Namemethyl (2S)-3-methyl-2-[pentanoyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoate
Molecular FormulaC25H31N5O3
Molecular Weight449.5
XLogP4.7
Topological Polar Surface Area101
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Heavy Atom Count33
Formal Charge0
Complexity623
SMILES
CCCCC(=O)N(CC1=CC=C(C=C1)C2=CC=CC=C2C3=NNN=N3)[C@@H](C(C)C)C(=O)OC
InChI
InChI=1S/C25H31N5O3/c1-5-6-11-22(31)30(23(17(2)3)25(32)33-4)16-18-12-14-19(15-13-18)20-9-7-8-10-21(20)24-26-28-29-27-24/h7-10,12-15,17,23H,5-6,11,16H2,1-4H3,(H,26,27,28,29)/t23-/m0/s1
InChIKey
UJTNRXYTECQKFO-QHCPKHFHSA-N
Chemical Structure
2D Structure
2D structure of N-(1-Oxopentyl)-N-((2'-(2H-tetrazol-5-yl)(1,1'-biphenyl)-4-yl)methyl)-L-valine methyl ester
CAS: 137863-17-3
CID: 11561462
Formula: C25H31N5O3
MW: 449.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight449.5
XLogP34.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Exact Mass449.24268987
Monoisotopic Mass449.24268987
Topological Polar Surface Area101 Ų
Heavy Atom Count33
Formal Charge0
Complexity623
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

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HY-18204A-01Sacubitril/Valsartan
HY-I1208-01D-Valsartan
HY-18204S1Valsartan-d3
HY-18204R-01Valsartan (Standard)
HY-18204SValsartan-d9

Alternative Products

CatalogName
CS-O-10333Valsartan Methyl Ester
CS-EO-04004Valsartan Desvaleryl Methyl Ester
167046Valsartan Methyl Ester-d9
TRC-N002960-100MGNitroso Valsartan Methyl Ester
CS-O-56876D-Valsartan methyl ester
CS-O-45535Trityl valsartan methyl ester
RM-V192005-01Valsartan Related Compound E; Valsartan Methyl Ester
GTR19305290-01N-Nitroso Valsartan Methyl Ester
AR-V01134-01Valsartan Cyano Desvaleryl Methyl Ester
AR-V01135-01Valsartan Cyano Analog Methyl Ester

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