S-2-(3-aminopropylamino)propylphosphorothioate
TL;DR: S-2-(3-aminopropylamino)propylphosphorothioate (CAS 20709-39-1) is a chemical compound with molecular formula C6H17N2O3PS and molecular weight 228.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-aminopropylamino)propylsulfanylphosphonic acid
Also Known As: S-2-(3-Aminopropylamino)propyl phosphorothioic acid, 3-(3-aminopropylamino)propylsulfanylphosphonic acid, S-2-(3-AMINOPROPYLAMINO)PROPYLPHOSPHOROTHIOATE, 1-Propanethiol, dihydrogen phosphate (ester), S-(3-((3-Aminopropyl)amino)propyl) dihydrogen phosphorothioate
| Molecular Formula | C6H17N2O3PS |
|---|---|
| Molecular Weight | 228.07 g/mol |
| LogP | -4.1 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 228.06975 |
| Heavy Atoms | 13 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 20709-39-1 |
|---|---|
| SMILES | C(CN)CNCCCSP(=O)(O)O |
| InChIKey | FVJTYCJHQHSYGS-UHFFFAOYSA-N |
Product Overview
S-2-(3-aminopropylamino)propylphosphorothioate (CAS 20709-39-1), with molecular formula C6H17N2O3PS and molecular weight 228.07 g/mol. IUPAC: 3-(3-aminopropylamino)propylsulfanylphosphonic acid.
Chemical Property Profile of S-2-(3-aminopropylamino)propylphosphorothioate
Property Insights of S-2-(3-aminopropylamino)propylphosphorothioate
The XLogP value of -4.1 indicates that S-2-(3-aminopropylamino)propylphosphorothioate 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 S-2-(3-aminopropylamino)propylphosphorothioate. Following Lipinski's Rule of Five, S-2-(3-aminopropylamino)propylphosphorothioate 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 S-2-(3-aminopropylamino)propylphosphorothioate?
The CAS number of S-2-(3-aminopropylamino)propylphosphorothioate is 20709-39-1.
What is the molecular formula of S-2-(3-aminopropylamino)propylphosphorothioate?
The molecular formula of S-2-(3-aminopropylamino)propylphosphorothioate is C6H17N2O3PS.
What is the molecular weight of S-2-(3-aminopropylamino)propylphosphorothioate?
The molecular weight of S-2-(3-aminopropylamino)propylphosphorothioate is 228.07 g/mol.
Where can I buy S-2-(3-aminopropylamino)propylphosphorothioate?
You can request a quote for S-2-(3-aminopropylamino)propylphosphorothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-2-(3-aminopropylamino)propylphosphorothioate?
Yes, KEHONG BIO provides custom synthesis services for S-2-(3-aminopropylamino)propylphosphorothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.