![Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate structure](/static/products/4781/478163-47-2.webp)
Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate
TL;DR: Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate (CAS 478163-47-2) is a chemical compound with molecular formula C10H19NO4S and molecular weight 249.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanylpropanoate
Also Known As: ethyl 2-{[(tert-butoxy)carbonyl]amino}-3-sulfanylpropanoate, 9P-020, ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate, ethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanylpropanoate
| Molecular Formula | C10H19NO4S |
|---|---|
| Molecular Weight | 249.10 g/mol |
| LogP | 1.3726 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.10349 |
| Heavy Atoms | 16 |
| Complexity | 249.6938 |
Chemical Identifiers
| CAS Number | 478163-47-2 |
|---|---|
| SMILES | CCOC(=O)C(CS)NC(=O)OC(C)(C)C |
Product Overview
Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate (CAS 478163-47-2), with molecular formula C10H19NO4S and molecular weight 249.10 g/mol. IUPAC: ethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanylpropanoate.
Chemical Property Profile of Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate
Property Insights of Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate
The XLogP value of 1.3726 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate. Following Lipinski's Rule of Five, Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate 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 Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate?
The CAS number of Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate is 478163-47-2.
What is the molecular formula of Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate?
The molecular formula of Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate is C10H19NO4S.
What is the molecular weight of Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate?
The molecular weight of Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate is 249.10 g/mol.
Where can I buy Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate?
You can request a quote for Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[(tert-butoxycarbonyl)amino]-3-sulfanylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.