Cythioate
TL;DR: Cythioate (CAS 115-93-5) is a chemical compound with molecular formula C8H12NO5PS2 and molecular weight 296.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-dimethoxyphosphinothioyloxybenzenesulfonamide
Also Known As: CYTHIOATE, Proban, Cyflee, Cythoate, Cythioate [BAN]
| Molecular Formula | C8H12NO5PS2 |
|---|---|
| Molecular Weight | 296.99 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.98944 |
| Heavy Atoms | 17 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 115-93-5 |
|---|---|
| SMILES | COP(=S)(OC)OC1=CC=C(C=C1)S(=O)(=O)N |
| InChIKey | BSBSDQUZDZXGFN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cythioate (CAS 115-93-5), with molecular formula C8H12NO5PS2 and molecular weight 296.99 g/mol. IUPAC: 4-dimethoxyphosphinothioyloxybenzenesulfonamide.
Chemical Property Profile of Cythioate
Property Insights of Cythioate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cythioate. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Cythioate. Following Lipinski's Rule of Five, Cythioate 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 Cythioate?
The CAS number of Cythioate is 115-93-5.
What is the molecular formula of Cythioate?
The molecular formula of Cythioate is C8H12NO5PS2.
What is the molecular weight of Cythioate?
The molecular weight of Cythioate is 296.99 g/mol.
Where can I buy Cythioate?
You can request a quote for Cythioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cythioate?
Yes, KEHONG BIO provides custom synthesis services for Cythioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.