S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate
TL;DR: S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate (CAS 159939-87-4) is a chemical compound with molecular formula C11H26NO2PS and molecular weight 267.14218 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-diethyl-2-[methyl(2-methylpropoxy)phosphoryl]sulfanylethanamine
Also Known As: Russian VX, VR nerve agent, Russian-VX, R-VX, VR (nerve agent)
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H26NO2PS |
| Molecular Weight | 267.14218 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 54.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 267.14218 Da |
| Heavy Atoms | 16 |
| Complexity | 220.0 |
| SMILES | CCN(CC)CCSP(=O)(C)OCC(C)C |
| InChIKey | MNLAVFKVRUQAKW-UHFFFAOYSA-N |
Chemical Property Profile of S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate
Property Insights of S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate. With a topological polar surface area (TPSA) of 54.8 Ų, S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate?
The CAS number of S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate is 159939-87-4.
What is the molecular formula of S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate?
The molecular formula of S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate is C11H26NO2PS.
What is the molecular weight of S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate?
The molecular weight of S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate is 267.14218 g/mol.
Where can I buy S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate?
You can request a quote for S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate?
Yes, CoreyChem provides custom synthesis services for S-(2-(Diethylamino)ethyl) O-(2-methylpropyl) P-methylphosphonothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.