O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate
TL;DR: O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate (CAS 51170-88-8) is a chemical compound with molecular formula C14H19Cl2N2O2PS and molecular weight 380.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dichlorophenyl)-1-diethoxyphosphinothioylpyrrolidin-2-imine
Also Known As: Phosphonothioicacid,(2-( -,O,O-diethylester, O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate, N-(2,4-dichlorophenyl)-1-diethoxyphosphinothioylpyrrolidin-2-imine, Phosphonothioic acid, (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)-, O,O-diethyl ester
| Molecular Formula | C14H19Cl2N2O2PS |
|---|---|
| Molecular Weight | 380.03 g/mol |
| LogP | 5.4167 |
| Topological Polar Surface Area | 34.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 380.0282 |
| Heavy Atoms | 22 |
| Complexity | 602.5057 |
Chemical Identifiers
| CAS Number | 51170-88-8 |
|---|---|
| SMILES | CCOP(=S)(N1CCCC1=NC2=C(C=C(C=C2)Cl)Cl)OCC |
Product Overview
O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate (CAS 51170-88-8), with molecular formula C14H19Cl2N2O2PS and molecular weight 380.03 g/mol. IUPAC: N-(2,4-dichlorophenyl)-1-diethoxyphosphinothioylpyrrolidin-2-imine.
Chemical Property Profile of O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate
Property Insights of O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate
The XLogP value of 5.4167 indicates that O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.06 Ų, O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate?
The CAS number of O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate is 51170-88-8.
What is the molecular formula of O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate?
The molecular formula of O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate is C14H19Cl2N2O2PS.
What is the molecular weight of O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate?
The molecular weight of O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate is 380.03 g/mol.
Where can I buy O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate?
You can request a quote for O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate?
Yes, KEHONG BIO provides custom synthesis services for O,O-Diethyl (2-((2,4-dichlorophenyl)imino)-1-pyrrolidinyl)phosphonothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.