3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide
TL;DR: 3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide (CAS 517895-75-9) is a chemical compound with molecular formula C8H9N5O2S and molecular weight 239.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-4-(tetrazol-1-yl)benzenesulfonamide
Also Known As: 3-methyl-4-(tetrazol-1-yl)benzenesulfonamide, 3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide
| Molecular Formula | C8H9N5O2S |
|---|---|
| Molecular Weight | 239.05 g/mol |
| LogP | -0.38188 |
| Topological Polar Surface Area | 103.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 239.0477 |
| Heavy Atoms | 16 |
| Complexity | 605.36383 |
Chemical Identifiers
| CAS Number | 517895-75-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)S(=O)(=O)N)N2C=NN=N2 |
Product Overview
3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide (CAS 517895-75-9), with molecular formula C8H9N5O2S and molecular weight 239.05 g/mol. IUPAC: 3-methyl-4-(tetrazol-1-yl)benzenesulfonamide.
Chemical Property Profile of 3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide
Property Insights of 3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide
The XLogP value of -0.38188 indicates that 3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 103.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide. Following Lipinski's Rule of Five, 3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide 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 3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide?
The CAS number of 3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide is 517895-75-9.
What is the molecular formula of 3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide?
The molecular formula of 3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide is C8H9N5O2S.
What is the molecular weight of 3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide?
The molecular weight of 3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide is 239.05 g/mol.
Where can I buy 3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide?
You can request a quote for 3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)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-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.