Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester
TL;DR: Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester (CAS 20709-38-0) is a chemical compound with molecular formula C5H15N2O3PS and molecular weight 214.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-aminoethylamino)propylsulfanylphosphonic acid
Also Known As: Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester, 3-(2-aminoethylamino)propylsulfanylphosphonic acid, S-3-((2-Aminoethyl)amino)propyl dihydrogen phosphorothioate, Phosphorothioic acid, S-ester with 3-((2-aminoethyl)amino)propanethiol, Propanethiol, 3-((2-aminoethyl)amino)-, dihydrogen phosphorothioate (ester)
| Molecular Formula | C5H15N2O3PS |
|---|---|
| Molecular Weight | 214.05 g/mol |
| LogP | -4.5 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 214.05411 |
| Heavy Atoms | 12 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 20709-38-0 |
|---|---|
| SMILES | C(CNCCN)CSP(=O)(O)O |
| InChIKey | JSGVYZIZTZNDHK-UHFFFAOYSA-N |
Product Overview
Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester (CAS 20709-38-0), with molecular formula C5H15N2O3PS and molecular weight 214.05 g/mol. IUPAC: 3-(2-aminoethylamino)propylsulfanylphosphonic acid.
Chemical Property Profile of Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester
Property Insights of Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester
The XLogP value of -4.5 indicates that Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester. Following Lipinski's Rule of Five, Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester has 4 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 Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester?
The CAS number of Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester is 20709-38-0.
What is the molecular formula of Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester?
The molecular formula of Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester is C5H15N2O3PS.
What is the molecular weight of Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester?
The molecular weight of Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester is 214.05 g/mol.
Where can I buy Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester?
You can request a quote for Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorothioic acid, S-(3-((2-aminoethyl)amino)propyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.