RefChem:371106
TL;DR: RefChem:371106 (CAS 3172-04-1) is a chemical compound with molecular formula C10H16NO4PS3 and molecular weight 341.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-diethoxyphosphinothioylsulfanylbenzenesulfonamide
Also Known As: S-(p-Sulfamoylphenyl) O,O-diethylphosphorodithioate, 4-diethoxyphosphinothioylsulfanylbenzenesulfonamide, Phosphorodithioic acid, O,O-diethyl ester, S-ester with p-mercaptobenzenesulfonamide, O,O-Diethyl S-(4-sulfamoylphenyl) phosphorodithioate, Benzenesulfonamide, p-mercapto-, S-ester with O,O-diethylphosphorodithioate
| Molecular Formula | C10H16NO4PS3 |
|---|---|
| Molecular Weight | 341.00 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 340.9979 |
| Heavy Atoms | 19 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 3172-04-1 |
|---|---|
| SMILES | CCOP(=S)(OCC)SC1=CC=C(C=C1)S(=O)(=O)N |
| InChIKey | SYNGDJNSQZDNLX-UHFFFAOYSA-N |
Product Overview
RefChem:371106 (CAS 3172-04-1), with molecular formula C10H16NO4PS3 and molecular weight 341.00 g/mol. IUPAC: 4-diethoxyphosphinothioylsulfanylbenzenesulfonamide.
Chemical Property Profile of RefChem:371106
Property Insights of RefChem:371106
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:371106. The TPSA of 144.0 Ų indicates high polarity, suggesting RefChem:371106 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:371106 has 1 hydrogen bond donor(s) and 7 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 RefChem:371106?
The CAS number of RefChem:371106 is 3172-04-1.
What is the molecular formula of RefChem:371106?
The molecular formula of RefChem:371106 is C10H16NO4PS3.
What is the molecular weight of RefChem:371106?
The molecular weight of RefChem:371106 is 341.00 g/mol.
Where can I buy RefChem:371106?
You can request a quote for RefChem:371106 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:371106?
Yes, KEHONG BIO provides custom synthesis services for RefChem:371106 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.