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N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine structure
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N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine

TL;DR: N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine (CAS 105811-49-2) is a chemical compound with molecular formula C18H19IN8O4 and molecular weight 536.05756 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2R,3R,4S,5R)-2-[6-[2-(4-azido-3-(125I)iodophenyl)ethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Also Known As: Azpnea, N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine, N-{2-[4-Azido-3-(~125~I)iodophenyl]ethyl}adenosine, N-{2-[4-Azido-3-(~125~I)iodophenyl]ethyl}-9-pentofuranosyl-9H-purin-6-amine, (2R,3R,4S,5R)-2-[6-[2-(4-azido-3-(125I)iodanylphenyl)ethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

CAS Number
105811-49-2
Molecular Formula
C18H19IN8O4
Molecular Weight
536.05756 g/mol
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Technical Specifications

Molecular FormulaC18H19IN8O4
Molecular Weight536.05756 g/mol
XLogP3.2
Topological Polar Surface Area (TPSA)140.0 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors10
Rotatable Bonds7
Exact Mass536.05756 Da
Heavy Atoms31
Complexity658.0
SMILESC1=CC(=C(C=C1CCNC2=C3C(=NC=N2)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)[125I])N=[N+]=[N-]
InChIKeyJCAFOLRGWKNCGC-DVPMXGFESA-N

Chemical Property Profile of N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine

XLogP
3.2
TPSA (Topological Polar Surface Area)
140.0
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
10
Rotatable Bonds
7
Heavy Atoms
31
Complexity
658.0
Exact Mass
536.05756
Monoisotopic Mass
536.05756
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine

The XLogP value of 3.2 indicates that N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 140.0 Ų indicates high polarity, suggesting N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine?

The CAS number of N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine is 105811-49-2.

What is the molecular formula of N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine?

The molecular formula of N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine is C18H19IN8O4.

What is the molecular weight of N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine?

The molecular weight of N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine is 536.05756 g/mol.

Where can I buy N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine?

You can request a quote for N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine?

Yes, CoreyChem provides custom synthesis services for N(6)-2-(4-Azido-3-iodophenyl)ethyladenosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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