[4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate
TL;DR: [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate (CAS 27894-32-2) is a chemical compound with molecular formula C17H20N4O7S and molecular weight 424.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate
Also Known As: [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate|9-(2,3,4-Tri-O-acetyl-6-deoxyhexopyranosyl)-3,9-dihydro-6H-purine-6-thione
| Molecular Formula | C17H20N4O7S |
|---|---|
| Molecular Weight | 424.11 g/mol |
| LogP | 1.20129 |
| Topological Polar Surface Area | 134.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 424.10526 |
| Heavy Atoms | 29 |
| Complexity | 1003.073 |
Chemical Identifiers
| CAS Number | 27894-32-2 |
|---|---|
| SMILES | CC1C(C(C(C(O1)N2C=NC3=C2NC=NC3=S)OC(=O)C)OC(=O)C)OC(=O)C |
Product Overview
[4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate (CAS 27894-32-2), with molecular formula C17H20N4O7S and molecular weight 424.11 g/mol. IUPAC: [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate.
Chemical Property Profile of [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate
Property Insights of [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate
The XLogP value of 1.20129 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate. The TPSA of 134.63 Ų falls within the moderate polarity range, balancing permeability and solubility for [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate. Following Lipinski's Rule of Five, [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate has 1 hydrogen bond donor(s) and 10 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 [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate?
The CAS number of [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate is 27894-32-2.
What is the molecular formula of [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate?
The molecular formula of [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate is C17H20N4O7S.
What is the molecular weight of [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate?
The molecular weight of [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate is 424.11 g/mol.
Where can I buy [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate?
You can request a quote for [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-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 [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.