Disulfide, bis[4-(methylthio)-2-nitrophenyl]
TL;DR: Disulfide, bis[4-(methylthio)-2-nitrophenyl] (CAS 69443-71-6) is a chemical compound with molecular formula C14H12N2O4S4 and molecular weight 399.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylsulfanyl-1-[(4-methylsulfanyl-2-nitrophenyl)disulfanyl]-2-nitrobenzene
Also Known As: Bis(4-(methylthio)-2-nitrophenyl) disulfide, bis[4-2-nitrophenyl]persulfide, Bis[4- -2-nitrophenyl]persulfide, Disulfide, bis(4-(methylthio)-2-nitrophenyl), DISULFIDE, BIS[4-(METHYLTHIO)-2-NITROPHENYL]
| Molecular Formula | C14H12N2O4S4 |
|---|---|
| Molecular Weight | 399.97 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 193.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.968 |
| Heavy Atoms | 24 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 69443-71-6 |
|---|---|
| SMILES | CSC1=CC(=C(C=C1)SSC2=C(C=C(C=C2)SC)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | DWMWOPWJCOBNBE-UHFFFAOYSA-N |
Product Overview
Disulfide, bis[4-(methylthio)-2-nitrophenyl] (CAS 69443-71-6), with molecular formula C14H12N2O4S4 and molecular weight 399.97 g/mol. IUPAC: 4-methylsulfanyl-1-[(4-methylsulfanyl-2-nitrophenyl)disulfanyl]-2-nitrobenzene.
Chemical Property Profile of Disulfide, bis[4-(methylthio)-2-nitrophenyl]
Property Insights of Disulfide, bis[4-(methylthio)-2-nitrophenyl]
The XLogP value of 4.4 indicates that Disulfide, bis[4-(methylthio)-2-nitrophenyl] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 193.0 Ų indicates high polarity, suggesting Disulfide, bis[4-(methylthio)-2-nitrophenyl] may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Disulfide, bis[4-(methylthio)-2-nitrophenyl] has 0 hydrogen bond donor(s) and 8 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 Disulfide, bis[4-(methylthio)-2-nitrophenyl]?
The CAS number of Disulfide, bis[4-(methylthio)-2-nitrophenyl] is 69443-71-6.
What is the molecular formula of Disulfide, bis[4-(methylthio)-2-nitrophenyl]?
The molecular formula of Disulfide, bis[4-(methylthio)-2-nitrophenyl] is C14H12N2O4S4.
What is the molecular weight of Disulfide, bis[4-(methylthio)-2-nitrophenyl]?
The molecular weight of Disulfide, bis[4-(methylthio)-2-nitrophenyl] is 399.97 g/mol.
Where can I buy Disulfide, bis[4-(methylthio)-2-nitrophenyl]?
You can request a quote for Disulfide, bis[4-(methylthio)-2-nitrophenyl] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Disulfide, bis[4-(methylthio)-2-nitrophenyl]?
Yes, KEHONG BIO provides custom synthesis services for Disulfide, bis[4-(methylthio)-2-nitrophenyl] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.