![Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate structure](/static/products/5266/5266-60-4.webp)
Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate
TL;DR: Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate (CAS 5266-60-4) is a chemical compound with molecular formula C13H26NO5PS2 and molecular weight 371.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate
Also Known As: NIOSH/NY1860400, ethyl N-{[(diethoxyphosphorothioyl)thio]acetyl}isovalinate, ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate, Ethyl N-{[(diethoxyphosphorothioyl)sulfanyl]acetyl}isovalinate, N-(((Diethoxyphosphinothioyl)thio)acetyl)isovaline ethyl ester
| Molecular Formula | C13H26NO5PS2 |
|---|---|
| Molecular Weight | 371.10 g/mol |
| LogP | 2.8651 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 371.099 |
| Heavy Atoms | 22 |
| Complexity | 411.23462 |
Chemical Identifiers
| CAS Number | 5266-60-4 |
|---|---|
| SMILES | CCC(C)(C(=O)OCC)NC(=O)CSP(=S)(OCC)OCC |
Product Overview
Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate (CAS 5266-60-4), with molecular formula C13H26NO5PS2 and molecular weight 371.10 g/mol. IUPAC: ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate.
Chemical Property Profile of Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate
Property Insights of Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate
The XLogP value of 2.8651 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate. Following Lipinski's Rule of Five, Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate has 1 hydrogen bond donor(s) and 7 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-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate?
The CAS number of Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate is 5266-60-4.
What is the molecular formula of Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate?
The molecular formula of Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate is C13H26NO5PS2.
What is the molecular weight of Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate?
The molecular weight of Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate is 371.10 g/mol.
Where can I buy Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate?
You can request a quote for Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[(2-diethoxyphosphinothioylsulfanylacetyl)amino]-2-methylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.