Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate
TL;DR: Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate (CAS 56875-72-0) is a chemical compound with molecular formula C11H16N2O4 and molecular weight 240.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(1-butyl-2,5-dioxoimidazolidin-4-ylidene)acetate
Also Known As: ethyl 2-(1-butyl-2,5-dioxoimidazolidin-4-ylidene)acetate, Ethyl (1-butyl-2,5-dioxoimidazolidin-4-ylidene)acetate, ETHYL (2E)-2-(1-BUTYL-2,5-DIOXO-IMIDAZOLIDIN-4-YLIDENE)ACETATE
| Molecular Formula | C11H16N2O4 |
|---|---|
| Molecular Weight | 240.11 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 75.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 240.11101 |
| Heavy Atoms | 17 |
| Complexity | 362.0 |
Chemical Identifiers
| CAS Number | 56875-72-0 |
|---|---|
| SMILES | CCCCN1C(=O)C(=CC(=O)OCC)NC1=O |
| InChIKey | YZFQYOGJVXHYPR-UHFFFAOYSA-N |
Product Overview
Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate (CAS 56875-72-0), with molecular formula C11H16N2O4 and molecular weight 240.11 g/mol. IUPAC: ethyl 2-(1-butyl-2,5-dioxoimidazolidin-4-ylidene)acetate.
Chemical Property Profile of Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate
Property Insights of Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate. The TPSA of 75.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate. Following Lipinski's Rule of Five, Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate has 1 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 (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate?
The CAS number of Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate is 56875-72-0.
What is the molecular formula of Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate?
The molecular formula of Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate is C11H16N2O4.
What is the molecular weight of Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate?
The molecular weight of Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate is 240.11 g/mol.
Where can I buy Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate?
You can request a quote for Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl (2E)-2-(1-butyl-2,5-dioxo-imidazolidin-4-ylidene)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.