Diethyl cystinate
TL;DR: Diethyl cystinate (CAS 583-89-1) is a chemical compound with molecular formula C10H20N2O4S2 and molecular weight 296.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-amino-3-[(2-amino-3-ethoxy-3-oxopropyl)disulfanyl]propanoate
Also Known As: Diethyl cystinate, Cystine diethyl ester, dicysteine diethylester, CYSTINE, DIETHYL ESTER, L-cystine diethyl ester dihydrochloride
| Molecular Formula | C10H20N2O4S2 |
|---|---|
| Molecular Weight | 296.09 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 296.08646 |
| Heavy Atoms | 18 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 583-89-1 |
|---|---|
| SMILES | CCOC(=O)C(CSSCC(C(=O)OCC)N)N |
| InChIKey | CIKFAVCRANPUES-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethyl cystinate (CAS 583-89-1), with molecular formula C10H20N2O4S2 and molecular weight 296.09 g/mol. IUPAC: ethyl 2-amino-3-[(2-amino-3-ethoxy-3-oxopropyl)disulfanyl]propanoate.
Chemical Property Profile of Diethyl cystinate
Property Insights of Diethyl cystinate
The XLogP value of -0.3 indicates that Diethyl cystinate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 155.0 Ų indicates high polarity, suggesting Diethyl cystinate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Diethyl cystinate has 2 hydrogen bond donor(s) and 8 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 cystinate?
The CAS number of Diethyl cystinate is 583-89-1.
What is the molecular formula of Diethyl cystinate?
The molecular formula of Diethyl cystinate is C10H20N2O4S2.
What is the molecular weight of Diethyl cystinate?
The molecular weight of Diethyl cystinate is 296.09 g/mol.
Where can I buy Diethyl cystinate?
You can request a quote for Diethyl cystinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl cystinate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl cystinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.