[3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate
TL;DR: [3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate (CAS 173725-22-9) is a chemical compound with molecular formula C22H37NO9 and molecular weight 459.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-acetamido-3,4-diacetyloxy-6-octoxyoxan-2-yl)methyl acetate
Also Known As: ChemDiv1_019296, BAS 00673594, (5-acetamido-3,4-diacetyloxy-6-octoxyoxan-2-yl)methyl acetate, [3,4-BIS(ACETYLOXY)-5-ACETAMIDO-6-(OCTYLOXY)OXAN-2-YL]METHYL ACETATE, F0451-0778
| Molecular Formula | C22H37NO9 |
|---|---|
| Molecular Weight | 459.25 g/mol |
| LogP | 2.0196 |
| Topological Polar Surface Area | 126.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 13 |
| Exact Mass | 459.24683 |
| Heavy Atoms | 32 |
| Complexity | 624.52277 |
Chemical Identifiers
| CAS Number | 173725-22-9 |
|---|---|
| SMILES | CCCCCCCCOC1C(C(C(C(O1)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C |
Product Overview
[3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate (CAS 173725-22-9), with molecular formula C22H37NO9 and molecular weight 459.25 g/mol. IUPAC: (5-acetamido-3,4-diacetyloxy-6-octoxyoxan-2-yl)methyl acetate.
Chemical Property Profile of [3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate
Property Insights of [3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate
The XLogP value of 2.0196 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate. The TPSA of 126.46 Ų falls within the moderate polarity range, balancing permeability and solubility for [3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate. Following Lipinski's Rule of Five, [3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate has 1 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 [3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate?
The CAS number of [3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate is 173725-22-9.
What is the molecular formula of [3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate?
The molecular formula of [3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate is C22H37NO9.
What is the molecular weight of [3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate?
The molecular weight of [3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate is 459.25 g/mol.
Where can I buy [3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate?
You can request a quote for [3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)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-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate?
Yes, KEHONG BIO provides custom synthesis services for [3,4-Bis(acetyloxy)-5-acetamido-6-(octyloxy)oxan-2-YL]methyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.