S-(2-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate
TL;DR: S-(2-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate (CAS 3147-20-4) is a chemical compound with molecular formula C8H20NO3PS and molecular weight 241.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-diethoxyphosphorylsulfanyl-N,N-dimethylethanamine
Also Known As: N,N-Dimethyltetram, 217AO, 3-Fluorophenylacetonitrile, O,O-diethyl S-(2-dimethylaminoethyl) phosphorothioate, 2-diethoxyphosphorylsulfanyl-N,N-dimethylethanamine
| Molecular Formula | C8H20NO3PS |
|---|---|
| Molecular Weight | 241.09 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 64.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 241.09015 |
| Heavy Atoms | 14 |
| Complexity | 179.0 |
Chemical Identifiers
| CAS Number | 3147-20-4 |
|---|---|
| SMILES | CCOP(=O)(OCC)SCCN(C)C |
| InChIKey | GRPHSFSJUDRMKP-UHFFFAOYSA-N |
Product Overview
S-(2-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate (CAS 3147-20-4), with molecular formula C8H20NO3PS and molecular weight 241.09 g/mol. IUPAC: 2-diethoxyphosphorylsulfanyl-N,N-dimethylethanamine.
Chemical Property Profile of S-(2-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate
Property Insights of S-(2-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-(2-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate. The TPSA of 64.1 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(2-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate. Following Lipinski's Rule of Five, S-(2-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate has 0 hydrogen bond donor(s) and 5 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-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate?
The CAS number of S-(2-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate is 3147-20-4.
What is the molecular formula of S-(2-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate?
The molecular formula of S-(2-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate is C8H20NO3PS.
What is the molecular weight of S-(2-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate?
The molecular weight of S-(2-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate is 241.09 g/mol.
Where can I buy S-(2-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate?
You can request a quote for S-(2-(Dimethylamino)ethyl) O,O-diethyl 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-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate?
Yes, KEHONG BIO provides custom synthesis services for S-(2-(Dimethylamino)ethyl) O,O-diethyl phosphorothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.