Ethyl ester of formamidino-thiomethylphosphonic acid
TL;DR: Ethyl ester of formamidino-thiomethylphosphonic acid (CAS 74038-50-9) is a chemical compound with molecular formula C4H11N2O3PS2 and molecular weight 229.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(carbamimidoyldisulfanyl)methyl-ethoxyphosphinic acid
Also Known As: Ethyl ester of formamidino-thiomethylphosphonic acid, Phosphonic acid, mercaptomethyl-, ethyl ester, anhydrosulfide with 2-thiopseudourea, (carbamimidoyldisulfanyl)methyl-ethoxyphosphinic acid, [(carbamimidoyldisulfanyl)methyl](ethoxy)phosphinic acid, Ethyl hydrogen [(carbamimidoyldisulfanyl)methyl]phosphonate
| Molecular Formula | C4H11N2O3PS2 |
|---|---|
| Molecular Weight | 229.99 g/mol |
| LogP | 1.44067 |
| Topological Polar Surface Area | 96.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 229.99487 |
| Heavy Atoms | 12 |
| Complexity | 200.74199 |
Chemical Identifiers
| CAS Number | 74038-50-9 |
|---|---|
| SMILES | CCOP(=O)(CSSC(=N)N)O |
Product Overview
Ethyl ester of formamidino-thiomethylphosphonic acid (CAS 74038-50-9), with molecular formula C4H11N2O3PS2 and molecular weight 229.99 g/mol. IUPAC: (carbamimidoyldisulfanyl)methyl-ethoxyphosphinic acid.
Chemical Property Profile of Ethyl ester of formamidino-thiomethylphosphonic acid
Property Insights of Ethyl ester of formamidino-thiomethylphosphonic acid
The XLogP value of 1.44067 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl ester of formamidino-thiomethylphosphonic acid. The TPSA of 96.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl ester of formamidino-thiomethylphosphonic acid. Following Lipinski's Rule of Five, Ethyl ester of formamidino-thiomethylphosphonic acid has 3 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 ester of formamidino-thiomethylphosphonic acid?
The CAS number of Ethyl ester of formamidino-thiomethylphosphonic acid is 74038-50-9.
What is the molecular formula of Ethyl ester of formamidino-thiomethylphosphonic acid?
The molecular formula of Ethyl ester of formamidino-thiomethylphosphonic acid is C4H11N2O3PS2.
What is the molecular weight of Ethyl ester of formamidino-thiomethylphosphonic acid?
The molecular weight of Ethyl ester of formamidino-thiomethylphosphonic acid is 229.99 g/mol.
Where can I buy Ethyl ester of formamidino-thiomethylphosphonic acid?
You can request a quote for Ethyl ester of formamidino-thiomethylphosphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl ester of formamidino-thiomethylphosphonic acid?
Yes, KEHONG BIO provides custom synthesis services for Ethyl ester of formamidino-thiomethylphosphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.