2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid
TL;DR: 2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid (CAS 77890-13-2) is a chemical compound with molecular formula C9H18NO5PS and molecular weight 283.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[ethoxy(methyl)phosphoryl]sulfanylacetyl]amino]acetate
Also Known As: Glycine, N-(((ethoxymethylphosphinyl)thio)acetyl)-, ethyl ester, (R)-, ethyl 2-[[2-[ethoxy(methyl)phosphoryl]sulfanylacetyl]amino]acetate, (S)-N-(Mercaptoacetyl)glycine ethyl ester S-ester with ethyl methylphosphonothioate, Glycine, N-(((ethoxymethylphosphinyl)thio)acetyl)-, ethyl ester, (+-)-, Glycine, N-(((ethoxymethylphosphinyl)thio)acetyl)-, ethyl ester, (S)-
| Molecular Formula | C9H18NO5PS |
|---|---|
| Molecular Weight | 283.06 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 283.06433 |
| Heavy Atoms | 17 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 77890-13-2 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)CSP(=O)(C)OCC |
| InChIKey | KTRXCPPABSNJBO-UHFFFAOYSA-N |
Product Overview
2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid (CAS 77890-13-2), with molecular formula C9H18NO5PS and molecular weight 283.06 g/mol. IUPAC: ethyl 2-[[2-[ethoxy(methyl)phosphoryl]sulfanylacetyl]amino]acetate.
Chemical Property Profile of 2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid
Property Insights of 2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid
The XLogP value of -0.1 indicates that 2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid. Following Lipinski's Rule of Five, 2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid 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 2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid?
The CAS number of 2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid is 77890-13-2.
What is the molecular formula of 2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid?
The molecular formula of 2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid is C9H18NO5PS.
What is the molecular weight of 2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid?
The molecular weight of 2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid is 283.06 g/mol.
Where can I buy 2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid?
You can request a quote for 2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-((Ethoxy(methyl)phosphoryl)sulfanyl)-N-(2-ethoxy-2-oxoethyl)ethanimidic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.