![ethyl diethyl(tetraoxo)[?]carboxylate structure](/static/products/864/86497-77-0.png)
ethyl diethyl(tetraoxo)[?]carboxylate
TL;DR: ethyl diethyl(tetraoxo)[?]carboxylate (CAS 86497-77-0) is a chemical compound with molecular formula C16H19N3O8 and molecular weight 381.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4,12-diethyl-3,5,11,13-tetraoxo-7,9-dioxa-4,8,12-triazatetracyclo[6.6.0.02,6.010,14]tetradecane-1-carboxylate
Also Known As: ethyl diethyl(tetraoxo)[?]carboxylate, Ethyl 2,8-diethyl-1,3,7,9-tetraoxooctahydro-1H-pyrrolo(3,4-d)pyrrolo(3',4':4,5)isoxazolo(2,3-b)isoxazole-9b(6aH)-carboxylate, Ethyl 2,8-diethyl-1,3,7,9-tetraoxooctahydro-1H-pyrrolo[3,4-d]pyrrolo[3',4':4,5][1,2]oxazolo[2,3-b][1,2]oxazole-9b(6aH)-carboxylate, Ethyl 2,8-diethyl-1,3,7,9-tetraoxooctahydro-1H-pyrrolo[3,4-d]pyrrolo[3',4':4,5]isoxazolo[2,3-b]isoxazole-9b(6aH)-carboxylate
| Molecular Formula | C16H19N3O8 |
|---|---|
| Molecular Weight | 381.12 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 381.11722 |
| Heavy Atoms | 27 |
| Complexity | 717.0 |
Chemical Identifiers
| CAS Number | 86497-77-0 |
|---|---|
| SMILES | CCN1C(=O)C2C(C1=O)ON3C2(C4C(O3)C(=O)N(C4=O)CC)C(=O)OCC |
| InChIKey | OIDFFSLYRBWUBW-UHFFFAOYSA-N |
Product Overview
ethyl diethyl(tetraoxo)[?]carboxylate (CAS 86497-77-0), with molecular formula C16H19N3O8 and molecular weight 381.12 g/mol. IUPAC: ethyl 4,12-diethyl-3,5,11,13-tetraoxo-7,9-dioxa-4,8,12-triazatetracyclo[6.6.0.02,6.010,14]tetradecane-1-carboxylate.
Chemical Property Profile of ethyl diethyl(tetraoxo)[?]carboxylate
Property Insights of ethyl diethyl(tetraoxo)[?]carboxylate
The XLogP value of -1.0 indicates that ethyl diethyl(tetraoxo)[?]carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl diethyl(tetraoxo)[?]carboxylate. Following Lipinski's Rule of Five, ethyl diethyl(tetraoxo)[?]carboxylate has 0 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 ethyl diethyl(tetraoxo)[?]carboxylate?
The CAS number of ethyl diethyl(tetraoxo)[?]carboxylate is 86497-77-0.
What is the molecular formula of ethyl diethyl(tetraoxo)[?]carboxylate?
The molecular formula of ethyl diethyl(tetraoxo)[?]carboxylate is C16H19N3O8.
What is the molecular weight of ethyl diethyl(tetraoxo)[?]carboxylate?
The molecular weight of ethyl diethyl(tetraoxo)[?]carboxylate is 381.12 g/mol.
Where can I buy ethyl diethyl(tetraoxo)[?]carboxylate?
You can request a quote for ethyl diethyl(tetraoxo)[?]carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl diethyl(tetraoxo)[?]carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl diethyl(tetraoxo)[?]carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.