O-Methyl S,S-dipropyl phosphorotrithioate
TL;DR: O-Methyl S,S-dipropyl phosphorotrithioate (CAS 4104-03-4) is a chemical compound with molecular formula C7H17OPS3 and molecular weight 244.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methoxy-bis(propylsulfanyl)-sulfanylidene-λ5-phosphane
Also Known As: O-Methyl S,S-dipropyl phosphorotrithioate, Virginia carolina 3-668, Virginia carolina-3-668, ENT 27,184, O-Methyl-S,S-dipropyltrithiofosfat
| Molecular Formula | C7H17OPS3 |
|---|---|
| Molecular Weight | 244.02 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 244.01791 |
| Heavy Atoms | 12 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 4104-03-4 |
|---|---|
| SMILES | CCCSP(=S)(OC)SCCC |
| InChIKey | MHXLFSCMPIFFLS-UHFFFAOYSA-N |
Product Overview
O-Methyl S,S-dipropyl phosphorotrithioate (CAS 4104-03-4), with molecular formula C7H17OPS3 and molecular weight 244.02 g/mol. IUPAC: methoxy-bis(propylsulfanyl)-sulfanylidene-λ5-phosphane.
Chemical Property Profile of O-Methyl S,S-dipropyl phosphorotrithioate
Property Insights of O-Methyl S,S-dipropyl phosphorotrithioate
The XLogP value of 3.8 indicates that O-Methyl S,S-dipropyl phosphorotrithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for O-Methyl S,S-dipropyl phosphorotrithioate. Following Lipinski's Rule of Five, O-Methyl S,S-dipropyl phosphorotrithioate 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
Frequently Asked Questions
What is the CAS number of O-Methyl S,S-dipropyl phosphorotrithioate?
The CAS number of O-Methyl S,S-dipropyl phosphorotrithioate is 4104-03-4.
What is the molecular formula of O-Methyl S,S-dipropyl phosphorotrithioate?
The molecular formula of O-Methyl S,S-dipropyl phosphorotrithioate is C7H17OPS3.
What is the molecular weight of O-Methyl S,S-dipropyl phosphorotrithioate?
The molecular weight of O-Methyl S,S-dipropyl phosphorotrithioate is 244.02 g/mol.
Where can I buy O-Methyl S,S-dipropyl phosphorotrithioate?
You can request a quote for O-Methyl S,S-dipropyl phosphorotrithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-Methyl S,S-dipropyl phosphorotrithioate?
Yes, KEHONG BIO provides custom synthesis services for O-Methyl S,S-dipropyl phosphorotrithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.