3,6-Dioxopiperazine-2,5-diyl diacetate
TL;DR: 3,6-Dioxopiperazine-2,5-diyl diacetate (CAS 80478-60-0) is a chemical compound with molecular formula C8H10N2O6 and molecular weight 230.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-acetyloxy-3,6-dioxopiperazin-2-yl) acetate
Also Known As: 3,6-Dioxopiperazine-2,5-diyl diacetate, (5-acetyloxy-3,6-dioxopiperazin-2-yl) acetate, (5-acetoxy-3,6-dioxo-piperazin-2-yl) acetate
| Molecular Formula | C8H10N2O6 |
|---|---|
| Molecular Weight | 230.05 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.05388 |
| Heavy Atoms | 16 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 80478-60-0 |
|---|---|
| SMILES | CC(=O)OC1C(=O)NC(C(=O)N1)OC(=O)C |
| InChIKey | STYAPGJTPQZKPK-UHFFFAOYSA-N |
Product Overview
3,6-Dioxopiperazine-2,5-diyl diacetate (CAS 80478-60-0), with molecular formula C8H10N2O6 and molecular weight 230.05 g/mol. IUPAC: (5-acetyloxy-3,6-dioxopiperazin-2-yl) acetate.
Chemical Property Profile of 3,6-Dioxopiperazine-2,5-diyl diacetate
Property Insights of 3,6-Dioxopiperazine-2,5-diyl diacetate
The XLogP value of -1.3 indicates that 3,6-Dioxopiperazine-2,5-diyl diacetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6-Dioxopiperazine-2,5-diyl diacetate. Following Lipinski's Rule of Five, 3,6-Dioxopiperazine-2,5-diyl diacetate has 2 hydrogen bond donor(s) and 6 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 3,6-Dioxopiperazine-2,5-diyl diacetate?
The CAS number of 3,6-Dioxopiperazine-2,5-diyl diacetate is 80478-60-0.
What is the molecular formula of 3,6-Dioxopiperazine-2,5-diyl diacetate?
The molecular formula of 3,6-Dioxopiperazine-2,5-diyl diacetate is C8H10N2O6.
What is the molecular weight of 3,6-Dioxopiperazine-2,5-diyl diacetate?
The molecular weight of 3,6-Dioxopiperazine-2,5-diyl diacetate is 230.05 g/mol.
Where can I buy 3,6-Dioxopiperazine-2,5-diyl diacetate?
You can request a quote for 3,6-Dioxopiperazine-2,5-diyl diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Dioxopiperazine-2,5-diyl diacetate?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Dioxopiperazine-2,5-diyl diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.