4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide
TL;DR: 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide (CAS 32585-76-5) is a chemical compound with molecular formula C9H10N4O2S and molecular weight 238.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-(1,2,4-triazol-4-yl)benzenesulfonamide
Also Known As: 4-methyl-N-(1,2,4-triazol-4-yl)benzenesulfonamide, 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide, BAS 00406722, [(4-methylphenyl)sulfonyl]-1,2,4-triazol-4-ylamine, N-(4H-1,2,4-Triazol-4-yl)-p-toluenesulfonamide
| Molecular Formula | C9H10N4O2S |
|---|---|
| Molecular Weight | 238.05 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 85.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.05244 |
| Heavy Atoms | 16 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 32585-76-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NN2C=NN=C2 |
| InChIKey | KSSBPINERPXLSX-UHFFFAOYSA-N |
Product Overview
4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide (CAS 32585-76-5), with molecular formula C9H10N4O2S and molecular weight 238.05 g/mol. IUPAC: 4-methyl-N-(1,2,4-triazol-4-yl)benzenesulfonamide.
Chemical Property Profile of 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide
Property Insights of 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide. Following Lipinski's Rule of Five, 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide has 1 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 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide?
The CAS number of 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide is 32585-76-5.
What is the molecular formula of 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide?
The molecular formula of 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide is C9H10N4O2S.
What is the molecular weight of 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide?
The molecular weight of 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide is 238.05 g/mol.
Where can I buy 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide?
You can request a quote for 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.