Dioxiram
TL;DR: Dioxiram (CAS 6626-69-3) is a chemical compound with molecular formula C10H20N2O2S2 and molecular weight 264.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate
Also Known As: Dioxiram, disulfiram, Bis(diethylcarbamoyl)disulfide, tetraethyldicarbamoyl disulfide, S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate
| Molecular Formula | C10H20N2O2S2 |
|---|---|
| Molecular Weight | 264.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 91.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 264.09662 |
| Heavy Atoms | 16 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 6626-69-3 |
|---|---|
| SMILES | CCN(CC)C(=O)SSC(=O)N(CC)CC |
| InChIKey | RBAXVJRSGWIFEH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dioxiram (CAS 6626-69-3), with molecular formula C10H20N2O2S2 and molecular weight 264.10 g/mol. IUPAC: S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate.
Chemical Property Profile of Dioxiram
Property Insights of Dioxiram
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dioxiram. The TPSA of 91.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Dioxiram. Following Lipinski's Rule of Five, Dioxiram 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 Dioxiram?
The CAS number of Dioxiram is 6626-69-3.
What is the molecular formula of Dioxiram?
The molecular formula of Dioxiram is C10H20N2O2S2.
What is the molecular weight of Dioxiram?
The molecular weight of Dioxiram is 264.10 g/mol.
Where can I buy Dioxiram?
You can request a quote for Dioxiram directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dioxiram?
Yes, KEHONG BIO provides custom synthesis services for Dioxiram and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.