![[4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate structure](/static/products/3910/39102-68-6.webp)
[4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate
TL;DR: [4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate (CAS 39102-68-6) is a chemical compound with molecular formula C24H25N5O8 and molecular weight 511.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4,5-diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate
Also Known As: [4,5-diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate|n-benzoyl-9-(2,3,4-tri-o-acetyl-6-deoxyhexopyranosyl)-9h-purin-6-amine|6-{[Hydroxy(phenyl)methylidene]amino}-9-(2,3,4-tri-O-acetyl-6-deoxyhexopyranosyl)-9H-purine
| Molecular Formula | C24H25N5O8 |
|---|---|
| Molecular Weight | 511.17 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 511.17032 |
| Heavy Atoms | 37 |
| Complexity | 868.0 |
Chemical Identifiers
| CAS Number | 39102-68-6 |
|---|---|
| SMILES | CC1C(C(C(C(O1)N2C=NC3=C(N=CN=C32)NC(=O)C4=CC=CC=C4)OC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | MYVHPLAZTWAKDL-UHFFFAOYSA-N |
Product Overview
[4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate (CAS 39102-68-6), with molecular formula C24H25N5O8 and molecular weight 511.17 g/mol. IUPAC: [4,5-diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate.
Chemical Property Profile of [4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate
Property Insights of [4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate. The TPSA of 161.0 Ų indicates high polarity, suggesting [4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate 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 [4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate?
The CAS number of [4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate is 39102-68-6.
What is the molecular formula of [4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate?
The molecular formula of [4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate is C24H25N5O8.
What is the molecular weight of [4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate?
The molecular weight of [4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate is 511.17 g/mol.
Where can I buy [4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate?
You can request a quote for [4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-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-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [4,5-Diacetyloxy-6-(6-benzamidopurin-9-yl)-2-methyloxan-3-yl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.