Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate
TL;DR: Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate (CAS 63891-87-2) is a chemical compound with molecular formula C8H12N2O4 and molecular weight 200.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate
Also Known As: ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate, ethyl 5-methyl-3,6-dioxo-piperazine-2-carboxylate
| Molecular Formula | C8H12N2O4 |
|---|---|
| Molecular Weight | 200.08 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.07971 |
| Heavy Atoms | 14 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 63891-87-2 |
|---|---|
| SMILES | CCOC(=O)C1C(=O)NC(C(=O)N1)C |
| InChIKey | XBGRHEOUJFLHJT-UHFFFAOYSA-N |
Product Overview
Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate (CAS 63891-87-2), with molecular formula C8H12N2O4 and molecular weight 200.08 g/mol. IUPAC: ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate.
Chemical Property Profile of Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate
Property Insights of Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate
The XLogP value of -0.4 indicates that Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate has 2 hydrogen bond donor(s) and 4 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 Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate?
The CAS number of Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate is 63891-87-2.
What is the molecular formula of Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate?
The molecular formula of Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate is C8H12N2O4.
What is the molecular weight of Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate?
The molecular weight of Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate is 200.08 g/mol.
Where can I buy Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate?
You can request a quote for Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-methyl-3,6-dioxopiperazine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.