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Perindopril arginine

CAT: 0013-GTR19210936-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19210936-01Size:25 mg
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Description
This research compound combines perindopril arginine, an ACE inhibitor, with amlodipine, a dihydropyridine calcium channel blocker, for the study of hypertension. It is utilized in both in vitro and in vivo experimental models to investigate mechanisms of vasodilation, blood pressure regulation, and combination therapy efficacy.
CAS Number
612548-45-5
Field of Research
Metabolism Research, Pharmacology & Drug Discovery
Smiles
N[C@@H] (CCCNC (N) =N) C (O) =O.[H][C@]12C[C@H] (N (C (=O) [C@H] (C) N[C@@H] (CCC) C (=O) OCC) [C@@]1 ([H]) CCCC2) C (O) =O
Molecular Formula
C25H46N6O7
Molecular Weight
542.68
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Perindopril arginine

Perindopril arginine is an organoammonium salt obtained by combining perindopril with one molar equivalent of L-arginine. It has a role as an EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor and an antihypertensive agent. It contains a L-argininium(1+) and a perindopril(1-).

CAS Number612548-45-5
PubChem CID12068809
IUPAC Name(2S,3aS,7aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxopentan-2-yl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid;(2S)-2-amino-5-(diaminomethylideneamino)pentanoic acid
Molecular FormulaC25H46N6O7
Molecular Weight542.7
Topological Polar Surface Area224
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count10
Rotatable Bond Count14
Heavy Atom Count38
Formal Charge0
Complexity700
SMILES
CCC[C@@H](C(=O)OCC)N[C@@H](C)C(=O)N1[C@H]2CCCC[C@H]2C[C@H]1C(=O)O.C(C[C@@H](C(=O)O)N)CN=C(N)N
InChI
InChI=1S/C19H32N2O5.C6H14N4O2/c1-4-8-14(19(25)26-5-2)20-12(3)17(22)21-15-10-7-6-9-13(15)11-16(21)18(23)24;7-4(5(11)12)2-1-3-10-6(8)9/h12-16,20H,4-11H2,1-3H3,(H,23,24);4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t12-,13-,14-,15-,16-;4-/m00/s1
InChIKey
RYCSJJXKEWBUTI-YDYAIEMNSA-N
Chemical Structure
2D Structure
2D structure of Perindopril arginine
CAS: 612548-45-5
CID: 12068809
Formula: C25H46N6O7
MW: 542.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight542.7
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count10
Rotatable Bond Count14
Exact Mass542.34279783
Monoisotopic Mass542.34279783
Topological Polar Surface Area224 Ų
Heavy Atom Count38
Formal Charge0
Complexity700
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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