Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate
TL;DR: Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate (CAS 5740-25-0) is a chemical compound with molecular formula C11H18N2O5 and molecular weight 258.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[2-[(2-ethoxy-2-oxoethyl)amino]-2-oxoethyl]aziridine-2-carboxylate
Also Known As: BIM-0049219.P001, Diethyl-benzylmercaptomethyl-phosphinthioxid, ETHYL 1-(ETHOXYCARBONYLMETHYLCARBAMOYLMETHYL)AZIRIDINE-2-CARBOXYLATE, AB00095398-01, ethyl 1-[2-[(2-ethoxy-2-oxoethyl)amino]-2-oxoethyl]aziridine-2-carboxylate
| Molecular Formula | C11H18N2O5 |
|---|---|
| Molecular Weight | 258.12 g/mol |
| LogP | -1.087 |
| Topological Polar Surface Area | 84.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 258.12158 |
| Heavy Atoms | 18 |
| Complexity | 331.39526 |
Chemical Identifiers
| CAS Number | 5740-25-0 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)CN1CC1C(=O)OCC |
Product Overview
Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate (CAS 5740-25-0), with molecular formula C11H18N2O5 and molecular weight 258.12 g/mol. IUPAC: ethyl 1-[2-[(2-ethoxy-2-oxoethyl)amino]-2-oxoethyl]aziridine-2-carboxylate.
Chemical Property Profile of Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate
Property Insights of Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate
The XLogP value of -1.087 indicates that Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.71 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate has 1 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 Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate?
The CAS number of Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate is 5740-25-0.
What is the molecular formula of Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate?
The molecular formula of Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate is C11H18N2O5.
What is the molecular weight of Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate?
The molecular weight of Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate is 258.12 g/mol.
Where can I buy Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate?
You can request a quote for Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-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 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-(ethoxycarbonylmethylcarbamoylmethyl)aziridine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.