双吡啶硫酮
TL;DR: 双吡啶硫酮 (CAS 3696-28-4) is a chemical compound with molecular formula C10H8N2O2S2 and molecular weight 252.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
双吡啶硫酮
1-oxido-2-[(1-oxidopyridin-1-ium-2-yl)disulfanyl]pyridin-1-ium
Also Known As: dipyrithione, Bispyrithione, Omadine disulfide, Dipiritiona, OMDS
| Molecular Formula | C10H8N2O2S2 |
|---|---|
| Molecular Weight | 252.00 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.00272 |
| Heavy Atoms | 16 |
| Complexity | 199.0 |
| Melting Point | 205 |
| Boiling Point | 582.8 |
Chemical Identifiers
| CAS Number | 3696-28-4 |
|---|---|
| SMILES | C1=CC=[N+](C(=C1)SSC2=CC=CC=[N+]2[O-])[O-] |
| InChIKey | ZHDBTKPXEJDTTQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
双吡啶硫酮 (CAS 3696-28-4), with molecular formula C10H8N2O2S2 and molecular weight 252.00 g/mol. IUPAC: 1-oxido-2-[(1-oxidopyridin-1-ium-2-yl)disulfanyl]pyridin-1-ium.
Chemical Property Profile of 双吡啶硫酮
Property Insights of 双吡啶硫酮
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 双吡啶硫酮. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 双吡啶硫酮. Following Lipinski's Rule of Five, Dipyrithione 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 Dipyrithione?
The CAS number of Dipyrithione is 3696-28-4.
What is the molecular formula of Dipyrithione?
The molecular formula of Dipyrithione is C10H8N2O2S2.
What is the molecular weight of Dipyrithione?
The molecular weight of Dipyrithione is 252.00 g/mol.
Where can I buy Dipyrithione?
You can request a quote for Dipyrithione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dipyrithione?
Yes, KEHONG BIO provides custom synthesis services for Dipyrithione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.