Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate
TL;DR: Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate (CAS 56598-92-6) is a chemical compound with molecular formula C14H16N2O4 and molecular weight 276.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate
Also Known As: 3-METHYL-2, ETHYL ESTER, ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate, ETHYL 1-BENZYL-3-METHYL-2,5-DIOXO-IMIDAZOLIDINE-4-CARBOXYLATE, 1-benzyl-3-methyl-2,5-dioxo-imidazolidine-4-carboxylic acid ethyl ester
| Molecular Formula | C14H16N2O4 |
|---|---|
| Molecular Weight | 276.11 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 66.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 276.111 |
| Heavy Atoms | 20 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 56598-92-6 |
|---|---|
| SMILES | CCOC(=O)C1C(=O)N(C(=O)N1C)CC2=CC=CC=C2 |
| InChIKey | YJCCBKGIATYQDZ-UHFFFAOYSA-N |
Product Overview
Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate (CAS 56598-92-6), with molecular formula C14H16N2O4 and molecular weight 276.11 g/mol. IUPAC: ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate.
Chemical Property Profile of Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate
Property Insights of Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate has 0 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 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate?
The CAS number of Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate is 56598-92-6.
What is the molecular formula of Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate?
The molecular formula of Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate is C14H16N2O4.
What is the molecular weight of Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate?
The molecular weight of Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate is 276.11 g/mol.
Where can I buy Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate?
You can request a quote for Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-benzyl-3-methyl-2,5-dioxoimidazolidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.