![4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide structure](/static/products/2126/21268-02-0.webp)
4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide
TL;DR: 4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide (CAS 21268-02-0) is a chemical compound with molecular formula C19H19N7O4S2 and molecular weight 473.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[[9-[(4-sulfamoylphenyl)methyl]purin-6-yl]amino]methyl]benzenesulfonamide
Also Known As: N,9-Bis[p-sulfamoylbenzyl]adenine, 4-({6-[(4-sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide, 4-[[[9-[(4-sulfamoylphenyl)methyl]purin-6-yl]amino]methyl]benzenesulfonamide, 4-[[[9-[(4-sulfamoylphenyl)methyl]purin-6-yl]amino]methyl]be, 4-(((9-(4-Sulfamoylbenzyl)-9H-purin-6-yl)amino)methyl)benzenesulfonamide
| Molecular Formula | C19H19N7O4S2 |
|---|---|
| Molecular Weight | 473.09 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 193.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 473.094 |
| Heavy Atoms | 32 |
| Complexity | 829.0 |
Chemical Identifiers
| CAS Number | 21268-02-0 |
|---|---|
| SMILES | C1=CC(=CC=C1CNC2=C3C(=NC=N2)N(C=N3)CC4=CC=C(C=C4)S(=O)(=O)N)S(=O)(=O)N |
| InChIKey | NWRGFUOYPBTKEC-UHFFFAOYSA-N |
Product Overview
4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide (CAS 21268-02-0), with molecular formula C19H19N7O4S2 and molecular weight 473.09 g/mol. IUPAC: 4-[[[9-[(4-sulfamoylphenyl)methyl]purin-6-yl]amino]methyl]benzenesulfonamide.
Chemical Property Profile of 4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide
Property Insights of 4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide. The TPSA of 193.0 Ų indicates high polarity, suggesting 4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide has 3 hydrogen bond donor(s) and 10 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 4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide?
The CAS number of 4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide is 21268-02-0.
What is the molecular formula of 4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide?
The molecular formula of 4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide is C19H19N7O4S2.
What is the molecular weight of 4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide?
The molecular weight of 4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide is 473.09 g/mol.
Where can I buy 4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide?
You can request a quote for 4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-({6-[(4-Sulfamoylbenzyl)amino]-9h-purin-9-yl}methyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.