4,4'-Dithiobis(3-nitrobenzenesulfonamide)
TL;DR: 4,4'-Dithiobis(3-nitrobenzenesulfonamide) (CAS 100137-37-9) is a chemical compound with molecular formula C12H10N4O8S4 and molecular weight 465.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitro-4-[(2-nitro-4-sulfamoylphenyl)disulfanyl]benzenesulfonamide
Also Known As: 4,4'-Dithiobis(3-nitrobenzenesulfonamide), Benzenesulfonamide, 4,4'-dithiobis(3-nitro-, 4,4 -Dithiobis(3-nitrobenzenesulfonamide), Benzenesulfonamide, 4,4'-dithiobis[3-nitro-, Benzenesulfonamide,4,4'-dithiobis[3-nitro- (6CI,9CI)
| Molecular Formula | C12H10N4O8S4 |
|---|---|
| Molecular Weight | 465.94 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 279.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 465.93814 |
| Heavy Atoms | 28 |
| Complexity | 729.0 |
Chemical Identifiers
| CAS Number | 100137-37-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1S(=O)(=O)N)[N+](=O)[O-])SSC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-] |
| InChIKey | BMNWYRSTEGXYJW-UHFFFAOYSA-N |
Product Overview
4,4'-Dithiobis(3-nitrobenzenesulfonamide) (CAS 100137-37-9), with molecular formula C12H10N4O8S4 and molecular weight 465.94 g/mol. IUPAC: 3-nitro-4-[(2-nitro-4-sulfamoylphenyl)disulfanyl]benzenesulfonamide.
Chemical Property Profile of 4,4'-Dithiobis(3-nitrobenzenesulfonamide)
Property Insights of 4,4'-Dithiobis(3-nitrobenzenesulfonamide)
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4'-Dithiobis(3-nitrobenzenesulfonamide). The TPSA of 279.0 Ų indicates high polarity, suggesting 4,4'-Dithiobis(3-nitrobenzenesulfonamide) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4,4'-Dithiobis(3-nitrobenzenesulfonamide) has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4'-Dithiobis(3-nitrobenzenesulfonamide)?
The CAS number of 4,4'-Dithiobis(3-nitrobenzenesulfonamide) is 100137-37-9.
What is the molecular formula of 4,4'-Dithiobis(3-nitrobenzenesulfonamide)?
The molecular formula of 4,4'-Dithiobis(3-nitrobenzenesulfonamide) is C12H10N4O8S4.
What is the molecular weight of 4,4'-Dithiobis(3-nitrobenzenesulfonamide)?
The molecular weight of 4,4'-Dithiobis(3-nitrobenzenesulfonamide) is 465.94 g/mol.
Where can I buy 4,4'-Dithiobis(3-nitrobenzenesulfonamide)?
You can request a quote for 4,4'-Dithiobis(3-nitrobenzenesulfonamide) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-Dithiobis(3-nitrobenzenesulfonamide)?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-Dithiobis(3-nitrobenzenesulfonamide) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.