[4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate
TL;DR: [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate (CAS 19083-22-8) is a chemical compound with molecular formula C14H16N4O6S and molecular weight 368.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate
Also Known As: [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate|9-(2,3-Di-O-acetylpentofuranosyl)-3,9-dihydro-6H-purine-6-thione
| Molecular Formula | C14H16N4O6S |
|---|---|
| Molecular Weight | 368.08 g/mol |
| LogP | 0.24199 |
| Topological Polar Surface Area | 128.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 368.07904 |
| Heavy Atoms | 25 |
| Complexity | 864.3692 |
Chemical Identifiers
| CAS Number | 19083-22-8 |
|---|---|
| SMILES | CC(=O)OC1C(OC(C1OC(=O)C)N2C=NC3=C2NC=NC3=S)CO |
Product Overview
[4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate (CAS 19083-22-8), with molecular formula C14H16N4O6S and molecular weight 368.08 g/mol. IUPAC: [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate.
Chemical Property Profile of [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate
Property Insights of [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate
The XLogP value of 0.24199 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate. The TPSA of 128.56 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate. Following Lipinski's Rule of Five, [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate has 2 hydrogen bond donor(s) and 9 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 [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate?
The CAS number of [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate is 19083-22-8.
What is the molecular formula of [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate?
The molecular formula of [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate is C14H16N4O6S.
What is the molecular weight of [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate?
The molecular weight of [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate is 368.08 g/mol.
Where can I buy [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate?
You can request a quote for [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [4-acetyloxy-2-(hydroxymethyl)-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.