alpha-Toluenesulfonamide, N-(purin-6-yl)-
TL;DR: alpha-Toluenesulfonamide, N-(purin-6-yl)- (CAS 82499-19-2) is a chemical compound with molecular formula C12H11N5O2S and molecular weight 289.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-7H-purine-6-sulfonamide
Also Known As: N-benzyl-7H-purine-6-sulfonamide, NCIOpen2_002804, alpha-Toluenesulfonamide, N-(purin-6-yl)-, N-(Purin-6-yl)-alpha-toluenesulfonamide, 1H-Purine-6-sulfonamide, N-(phenylmethyl)-
| Molecular Formula | C12H11N5O2S |
|---|---|
| Molecular Weight | 289.06 g/mol |
| LogP | 0.8314 |
| Topological Polar Surface Area | 100.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.06335 |
| Heavy Atoms | 20 |
| Complexity | 829.1897 |
Chemical Identifiers
| CAS Number | 82499-19-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNS(=O)(=O)C2=NC=NC3=C2NC=N3 |
Product Overview
alpha-Toluenesulfonamide, N-(purin-6-yl)- (CAS 82499-19-2), with molecular formula C12H11N5O2S and molecular weight 289.06 g/mol. IUPAC: N-benzyl-7H-purine-6-sulfonamide.
Chemical Property Profile of alpha-Toluenesulfonamide, N-(purin-6-yl)-
Property Insights of alpha-Toluenesulfonamide, N-(purin-6-yl)-
The XLogP value of 0.8314 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-Toluenesulfonamide, N-(purin-6-yl)-. The TPSA of 100.63 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha-Toluenesulfonamide, N-(purin-6-yl)-. Following Lipinski's Rule of Five, alpha-Toluenesulfonamide, N-(purin-6-yl)- has 2 hydrogen bond donor(s) and 5 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 alpha-Toluenesulfonamide, N-(purin-6-yl)-?
The CAS number of alpha-Toluenesulfonamide, N-(purin-6-yl)- is 82499-19-2.
What is the molecular formula of alpha-Toluenesulfonamide, N-(purin-6-yl)-?
The molecular formula of alpha-Toluenesulfonamide, N-(purin-6-yl)- is C12H11N5O2S.
What is the molecular weight of alpha-Toluenesulfonamide, N-(purin-6-yl)-?
The molecular weight of alpha-Toluenesulfonamide, N-(purin-6-yl)- is 289.06 g/mol.
Where can I buy alpha-Toluenesulfonamide, N-(purin-6-yl)-?
You can request a quote for alpha-Toluenesulfonamide, N-(purin-6-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Toluenesulfonamide, N-(purin-6-yl)-?
Yes, KEHONG BIO provides custom synthesis services for alpha-Toluenesulfonamide, N-(purin-6-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.