Diethyl 2-(ethylcarbamoylamino)propanedioate
TL;DR: Diethyl 2-(ethylcarbamoylamino)propanedioate (CAS 21823-91-6) is a chemical compound with molecular formula C10H18N2O5 and molecular weight 246.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-(ethylcarbamoylamino)propanedioate
Also Known As: Diethyl-N'-ethyl-ureidomalonat, diethyl 2-(ethylcarbamoylamino)propanedioate, diethyl 2-(3-ethylureido)malonate, Diethyl [(ethylcarbamoyl)amino]propanedioate
| Molecular Formula | C10H18N2O5 |
|---|---|
| Molecular Weight | 246.12 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 93.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 246.12157 |
| Heavy Atoms | 17 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 21823-91-6 |
|---|---|
| SMILES | CCNC(=O)NC(C(=O)OCC)C(=O)OCC |
| InChIKey | BXFFJTUDCGLBMI-UHFFFAOYSA-N |
Product Overview
Diethyl 2-(ethylcarbamoylamino)propanedioate (CAS 21823-91-6), with molecular formula C10H18N2O5 and molecular weight 246.12 g/mol. IUPAC: diethyl 2-(ethylcarbamoylamino)propanedioate.
Chemical Property Profile of Diethyl 2-(ethylcarbamoylamino)propanedioate
Property Insights of Diethyl 2-(ethylcarbamoylamino)propanedioate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 2-(ethylcarbamoylamino)propanedioate. The TPSA of 93.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-(ethylcarbamoylamino)propanedioate. Following Lipinski's Rule of Five, Diethyl 2-(ethylcarbamoylamino)propanedioate has 2 hydrogen bond donor(s) and 5 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 Diethyl 2-(ethylcarbamoylamino)propanedioate?
The CAS number of Diethyl 2-(ethylcarbamoylamino)propanedioate is 21823-91-6.
What is the molecular formula of Diethyl 2-(ethylcarbamoylamino)propanedioate?
The molecular formula of Diethyl 2-(ethylcarbamoylamino)propanedioate is C10H18N2O5.
What is the molecular weight of Diethyl 2-(ethylcarbamoylamino)propanedioate?
The molecular weight of Diethyl 2-(ethylcarbamoylamino)propanedioate is 246.12 g/mol.
Where can I buy Diethyl 2-(ethylcarbamoylamino)propanedioate?
You can request a quote for Diethyl 2-(ethylcarbamoylamino)propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2-(ethylcarbamoylamino)propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-(ethylcarbamoylamino)propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.