S-(2,3-Diaminopropyl) dihydrogen phosphorothioate
TL;DR: S-(2,3-Diaminopropyl) dihydrogen phosphorothioate (CAS 78219-00-8) is a chemical compound with molecular formula C3H11N2O3PS and molecular weight 186.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-diaminopropylsulfanylphosphonic acid
Also Known As: S-2,3-Diaminopropyl dihydrogen phosphorothioate, Phosphorothioic acid, S-2,3-diaminopropyl ester, 2,3-diaminopropylsulfanylphosphonic acid, Propylthiophosphonic acid, 2,3-diamino-, [(2,3-diaminopropyl)sulfanyl]phosphonic acid
| Molecular Formula | C3H11N2O3PS |
|---|---|
| Molecular Weight | 186.02 g/mol |
| LogP | -5.3 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 186.0228 |
| Heavy Atoms | 10 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 78219-00-8 |
|---|---|
| SMILES | C(C(CSP(=O)(O)O)N)N |
| InChIKey | TXLJMOJYKYDULH-UHFFFAOYSA-N |
Product Overview
S-(2,3-Diaminopropyl) dihydrogen phosphorothioate (CAS 78219-00-8), with molecular formula C3H11N2O3PS and molecular weight 186.02 g/mol. IUPAC: 2,3-diaminopropylsulfanylphosphonic acid.
Chemical Property Profile of S-(2,3-Diaminopropyl) dihydrogen phosphorothioate
Property Insights of S-(2,3-Diaminopropyl) dihydrogen phosphorothioate
The XLogP value of -5.3 indicates that S-(2,3-Diaminopropyl) dihydrogen phosphorothioate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(2,3-Diaminopropyl) dihydrogen phosphorothioate. Following Lipinski's Rule of Five, S-(2,3-Diaminopropyl) dihydrogen phosphorothioate 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-Diaminopropyl) dihydrogen phosphorothioate?
The CAS number of S-(2,3-Diaminopropyl) dihydrogen phosphorothioate is 78219-00-8.
What is the molecular formula of S-(2,3-Diaminopropyl) dihydrogen phosphorothioate?
The molecular formula of S-(2,3-Diaminopropyl) dihydrogen phosphorothioate is C3H11N2O3PS.
What is the molecular weight of S-(2,3-Diaminopropyl) dihydrogen phosphorothioate?
The molecular weight of S-(2,3-Diaminopropyl) dihydrogen phosphorothioate is 186.02 g/mol.
Where can I buy S-(2,3-Diaminopropyl) dihydrogen phosphorothioate?
You can request a quote for S-(2,3-Diaminopropyl) dihydrogen phosphorothioate 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-Diaminopropyl) dihydrogen phosphorothioate?
Yes, KEHONG BIO provides custom synthesis services for S-(2,3-Diaminopropyl) dihydrogen phosphorothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.