Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester
TL;DR: Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester (CAS 67242-39-1) is a chemical compound with molecular formula C5H12NO2PS and molecular weight 181.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[ethyl(methylsulfanyl)phosphoryl]acetamide
Also Known As: S-Methyl N-acetyl-P-ethylphosphonamidothioate, N-Acetyl-P-ethylphosphonamidothioic acid S-methyl ester, N-[ethyl(methylsulfanyl)phosphoryl]acetamide, Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester, N-[Ethyl(methylsulfanyl)phosphoryl]ethanimidic acid
| Molecular Formula | C5H12NO2PS |
|---|---|
| Molecular Weight | 181.03 g/mol |
| LogP | 1.6985 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 181.03264 |
| Heavy Atoms | 10 |
| Complexity | 163.03088 |
Chemical Identifiers
| CAS Number | 67242-39-1 |
|---|---|
| SMILES | CCP(=O)(NC(=O)C)SC |
Product Overview
Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester (CAS 67242-39-1), with molecular formula C5H12NO2PS and molecular weight 181.03 g/mol. IUPAC: N-[ethyl(methylsulfanyl)phosphoryl]acetamide.
Chemical Property Profile of Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester
Property Insights of Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester
The XLogP value of 1.6985 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester. With a topological polar surface area (TPSA) of 46.17 Ų, Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester has 1 hydrogen bond donor(s) and 3 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 Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester?
The CAS number of Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester is 67242-39-1.
What is the molecular formula of Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester?
The molecular formula of Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester is C5H12NO2PS.
What is the molecular weight of Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester?
The molecular weight of Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester is 181.03 g/mol.
Where can I buy Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester?
You can request a quote for Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonamidothioic acid, N-acetyl-P-ethyl-, S-methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.