S-(2-(Diethylamino)ethyl) methylphosphonothioate
TL;DR: S-(2-(Diethylamino)ethyl) methylphosphonothioate (CAS 23904-12-3) is a chemical compound with molecular formula C7H18NO2PS and molecular weight 211.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethylsulfanyl-methylphosphinic acid
Also Known As: S 27, S-(2-(Diethylamino)ethyl) methylphosphonothioate, 2-(diethylamino)ethylsulfanyl-methylphosphinic acid, S-27, J2.804.882C
| Molecular Formula | C7H18NO2PS |
|---|---|
| Molecular Weight | 211.08 g/mol |
| LogP | -2.2 |
| Topological Polar Surface Area | 65.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 211.07959 |
| Heavy Atoms | 12 |
| Complexity | 161.0 |
Chemical Identifiers
| CAS Number | 23904-12-3 |
|---|---|
| SMILES | CCN(CC)CCSP(=O)(C)O |
| InChIKey | VDVPFYBCCCESMG-UHFFFAOYSA-N |
Product Overview
S-(2-(Diethylamino)ethyl) methylphosphonothioate (CAS 23904-12-3), with molecular formula C7H18NO2PS and molecular weight 211.08 g/mol. IUPAC: 2-(diethylamino)ethylsulfanyl-methylphosphinic acid.
Chemical Property Profile of S-(2-(Diethylamino)ethyl) methylphosphonothioate
Property Insights of S-(2-(Diethylamino)ethyl) methylphosphonothioate
The XLogP value of -2.2 indicates that S-(2-(Diethylamino)ethyl) methylphosphonothioate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 65.8 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(2-(Diethylamino)ethyl) methylphosphonothioate. Following Lipinski's Rule of Five, S-(2-(Diethylamino)ethyl) methylphosphonothioate has 1 hydrogen bond donor(s) and 4 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-(Diethylamino)ethyl) methylphosphonothioate?
The CAS number of S-(2-(Diethylamino)ethyl) methylphosphonothioate is 23904-12-3.
What is the molecular formula of S-(2-(Diethylamino)ethyl) methylphosphonothioate?
The molecular formula of S-(2-(Diethylamino)ethyl) methylphosphonothioate is C7H18NO2PS.
What is the molecular weight of S-(2-(Diethylamino)ethyl) methylphosphonothioate?
The molecular weight of S-(2-(Diethylamino)ethyl) methylphosphonothioate is 211.08 g/mol.
Where can I buy S-(2-(Diethylamino)ethyl) methylphosphonothioate?
You can request a quote for S-(2-(Diethylamino)ethyl) methylphosphonothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(2-(Diethylamino)ethyl) methylphosphonothioate?
Yes, KEHONG BIO provides custom synthesis services for S-(2-(Diethylamino)ethyl) methylphosphonothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.