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Astiron

CAT: 0013-GTR19195713-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19195713-02Size:50 mg
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Description
Astiron is a self-expanding stent constructed from bare nitinol metal. It is utilized in cardiovascular and endovascular research, serving as a key model for studying stent performance and biocompatibility in both in vitro flow systems and in vivo animal studies.
CAS Number
1620-24-2
Smiles
[C@@H] (CC1=CC=C (O) C=C1) (NC (C (CC2=CC=C (N (CCCl) CCCl) C=C2) NC (C) =O) =O) C (OCC) =O
Molecular Formula
C26H33Cl2N3O5
Molecular Weight
538.46
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Astiron

structure in Negwer, 5th ed, #5509

CAS Number1620-24-2
PubChem CID3083728
IUPAC Nameethyl 2-[[2-acetamido-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoyl]amino]-3-(4-hydroxyphenyl)propanoate
Molecular FormulaC26H33Cl2N3O5
Molecular Weight538.5
XLogP3.2
Topological Polar Surface Area108
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count15
Heavy Atom Count36
Formal Charge0
Complexity676
SMILES
CCOC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C(CC2=CC=C(C=C2)N(CCCl)CCCl)NC(=O)C
InChI
InChI=1S/C26H33Cl2N3O5/c1-3-36-26(35)24(17-20-6-10-22(33)11-7-20)30-25(34)23(29-18(2)32)16-19-4-8-21(9-5-19)31(14-12-27)15-13-28/h4-11,23-24,33H,3,12-17H2,1-2H3,(H,29,32)(H,30,34)
InChIKey
SULYQGVAYSECAW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Astiron
CAS: 1620-24-2
CID: 3083728
Formula: C26H33Cl2N3O5
MW: 538.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight538.5
XLogP33.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count15
Exact Mass537.1797265
Monoisotopic Mass537.1797265
Topological Polar Surface Area108 Ų
Heavy Atom Count36
Formal Charge0
Complexity676
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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