N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide
TL;DR: N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide (CAS 36289-51-7) is a chemical compound with molecular formula C10H12N4O2S and molecular weight 252.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4,5-dimethyltriazol-1-yl)benzenesulfonamide
Also Known As: 1-(Phenylsulfonylamino)-4,5-dimethyl-triazole, N-(4,5-dimethyltriazol-1-yl)benzenesulfonamide, N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide, Benzenesulfonamide,N-(4,5-dimethyl-1H-1,2,3-triazol-1-yl), Benzenesulfonamide,N-(4,5-dimethyl-1H-1,2,3-triazol-1-yl)-
| Molecular Formula | C10H12N4O2S |
|---|---|
| Molecular Weight | 252.07 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 85.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.0681 |
| Heavy Atoms | 17 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 36289-51-7 |
|---|---|
| SMILES | CC1=C(N(N=N1)NS(=O)(=O)C2=CC=CC=C2)C |
| InChIKey | IBHAVMSEVLCQIM-UHFFFAOYSA-N |
Product Overview
N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide (CAS 36289-51-7), with molecular formula C10H12N4O2S and molecular weight 252.07 g/mol. IUPAC: N-(4,5-dimethyltriazol-1-yl)benzenesulfonamide.
Chemical Property Profile of N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide
Property Insights of N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide. Following Lipinski's Rule of Five, N-(4,5-Dimethyl-1H-1,2,3-triazol-1-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 N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide?
The CAS number of N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide is 36289-51-7.
What is the molecular formula of N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide?
The molecular formula of N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide is C10H12N4O2S.
What is the molecular weight of N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide?
The molecular weight of N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide is 252.07 g/mol.
Where can I buy N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide?
You can request a quote for N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.