n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine
TL;DR: n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine (CAS 35911-93-4) is a chemical compound with molecular formula C18H20ClN5O8 and molecular weight 469.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(2-acetamido-6-chloropurin-9-yl)-3,4-diacetyloxyoxolan-2-yl]methyl acetate
Also Known As: n-acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine, 2-Acetamido-6-chloro-9-(2',3',5'-tri-O-acetyl-beta-D-ribofuranosyl)purine, [5-(2-acetamido-6-chloropurin-9-yl)-3,4-diacetyloxyoxolan-2-yl]methyl acetate, 2-Acetamido-6-chloro-9-(2',3',5'-tri-O-acetyl-I(2)-D-ribofuranosyl)purine, (2R,3R,4R,5R)-2-(2-Acetamido-6-chloro-9H-purin-9-yl)-5-(acetoxymethyl)tetrahydrofuran-3,4-diyl diacetate
| Molecular Formula | C18H20ClN5O8 |
|---|---|
| Molecular Weight | 469.10 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 469.10004 |
| Heavy Atoms | 32 |
| Complexity | 757.0 |
Chemical Identifiers
| CAS Number | 35911-93-4 |
|---|---|
| SMILES | CC(=O)NC1=NC2=C(C(=N1)Cl)N=CN2C3C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | OVXYEIBYTBNNFE-UHFFFAOYSA-N |
Product Overview
n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine (CAS 35911-93-4), with molecular formula C18H20ClN5O8 and molecular weight 469.10 g/mol. IUPAC: [5-(2-acetamido-6-chloropurin-9-yl)-3,4-diacetyloxyoxolan-2-yl]methyl acetate.
Chemical Property Profile of n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine
Property Insights of n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine. The TPSA of 161.0 Ų indicates high polarity, suggesting n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine?
The CAS number of n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine is 35911-93-4.
What is the molecular formula of n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine?
The molecular formula of n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine is C18H20ClN5O8.
What is the molecular weight of n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine?
The molecular weight of n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine is 469.10 g/mol.
Where can I buy n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine?
You can request a quote for n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for n-Acetyl-6-chloro-9-(2,3,5-tri-o-acetylpentofuranosyl)-9h-purin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.