3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide
TL;DR: 3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide (CAS 925554-85-4) is a chemical compound with molecular formula C16H18N2O4S2 and molecular weight 366.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dimethyl-5-[[(E)-2-phenylethenyl]sulfonylamino]benzenesulfonamide
Also Known As: 3,4-dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide, 3,4-dimethyl-5-[[(E)-2-phenylethenyl]sulfonylamino]benzenesulfonamide
| Molecular Formula | C16H18N2O4S2 |
|---|---|
| Molecular Weight | 366.07 g/mol |
| LogP | 2.36344 |
| Topological Polar Surface Area | 106.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.0708 |
| Heavy Atoms | 24 |
| Complexity | 980.23755 |
Chemical Identifiers
| CAS Number | 925554-85-4 |
|---|---|
| SMILES | CC1=CC(=CC(=C1C)NS(=O)(=O)/C=C/C2=CC=CC=C2)S(=O)(=O)N |
Product Overview
3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide (CAS 925554-85-4), with molecular formula C16H18N2O4S2 and molecular weight 366.07 g/mol. IUPAC: 3,4-dimethyl-5-[[(E)-2-phenylethenyl]sulfonylamino]benzenesulfonamide.
Chemical Property Profile of 3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide
Property Insights of 3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide
The XLogP value of 2.36344 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide. The TPSA of 106.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide. Following Lipinski's Rule of Five, 3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide has 2 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 3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide?
The CAS number of 3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide is 925554-85-4.
What is the molecular formula of 3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide?
The molecular formula of 3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide is C16H18N2O4S2.
What is the molecular weight of 3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide?
The molecular weight of 3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide is 366.07 g/mol.
Where can I buy 3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide?
You can request a quote for 3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dimethyl-5-(2-phenylethenesulfonamido)benzene-1-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.