![[3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate structure](/static/products/4753/4753-00-8.webp)
[3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate
TL;DR: [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate (CAS 4753-00-8) is a chemical compound with molecular formula C37H45N3O18 and molecular weight 819.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate
Also Known As: [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate|2-[({4,5-Bis(acetyloxy)-6-[(acetyloxy)methyl]-3-benzamidooxan-2-yl}oxy)methyl]-6-(4-ethoxy-2-oxopyrimidin-1(2H)-yl)oxane-3,4,5-triyl triacetate
| Molecular Formula | C37H45N3O18 |
|---|---|
| Molecular Weight | 819.27 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 256.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 21 |
| Exact Mass | 819.26984 |
| Heavy Atoms | 58 |
| Complexity | 1610.0 |
Chemical Identifiers
| CAS Number | 4753-00-8 |
|---|---|
| SMILES | CCOC1=NC(=O)N(C=C1)C2C(C(C(C(O2)COC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C4=CC=CC=C4)OC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | IOXOSTIWANGKBQ-UHFFFAOYSA-N |
Product Overview
[3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate (CAS 4753-00-8), with molecular formula C37H45N3O18 and molecular weight 819.27 g/mol. IUPAC: [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate.
Chemical Property Profile of [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate
Property Insights of [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate. The TPSA of 256.0 Ų indicates high polarity, suggesting [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate has 1 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate?
The CAS number of [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate is 4753-00-8.
What is the molecular formula of [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate?
The molecular formula of [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate is C37H45N3O18.
What is the molecular weight of [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate?
The molecular weight of [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate is 819.27 g/mol.
Where can I buy [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate?
You can request a quote for [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate?
Yes, KEHONG BIO provides custom synthesis services for [3,4-diacetyloxy-5-benzamido-6-[[3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.