![N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide structure](/static/products/7724/77244-86-1.webp)
N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide
TL;DR: N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide (CAS 77244-86-1) is a chemical compound with molecular formula C17H17N5O3 and molecular weight 339.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide
Also Known As: Adenosine,3'-dideoxy-, N6-Benzoyl-2',3'-dideoxyadenosine, Adenosine, N(6)-benzoyl-2',3'-dideoxy-, N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide
| Molecular Formula | C17H17N5O3 |
|---|---|
| Molecular Weight | 339.13 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.13315 |
| Heavy Atoms | 25 |
| Complexity | 473.0 |
Chemical Identifiers
| CAS Number | 77244-86-1 |
|---|---|
| SMILES | C1CC(OC1CO)N2C=NC3=C(N=CN=C32)NC(=O)C4=CC=CC=C4 |
| InChIKey | ZNZDAJZEPSQWJN-UHFFFAOYSA-N |
Product Overview
N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide (CAS 77244-86-1), with molecular formula C17H17N5O3 and molecular weight 339.13 g/mol. IUPAC: N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide.
Chemical Property Profile of N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide
Property Insights of N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide. Following Lipinski's Rule of Five, N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide?
The CAS number of N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide is 77244-86-1.
What is the molecular formula of N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide?
The molecular formula of N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide is C17H17N5O3.
What is the molecular weight of N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide?
The molecular weight of N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide is 339.13 g/mol.
Where can I buy N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide?
You can request a quote for N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[9-[5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.