n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide
TL;DR: n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide (CAS 20009-25-0) is a chemical compound with molecular formula C13H17N3O2S2 and molecular weight 311.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide
Also Known As: n-(5-butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide, N-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzene-1-sulfonamide, N-(5-Butyl-1,3,4-thiadiazol-2-yl)-p-toluenesulfonamide
| Molecular Formula | C13H17N3O2S2 |
|---|---|
| Molecular Weight | 311.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 311.07623 |
| Heavy Atoms | 20 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 20009-25-0 |
|---|---|
| SMILES | CCCCC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)C |
| InChIKey | OFWASDFJBMOHBA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide (CAS 20009-25-0), with molecular formula C13H17N3O2S2 and molecular weight 311.08 g/mol. IUPAC: N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide.
Chemical Property Profile of n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide
Property Insights of n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide
The XLogP value of 3.0 indicates that n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide. Following Lipinski's Rule of Five, n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide has 1 hydrogen bond donor(s) and 6 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-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide?
The CAS number of n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide is 20009-25-0.
What is the molecular formula of n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide?
The molecular formula of n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide is C13H17N3O2S2.
What is the molecular weight of n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide?
The molecular weight of n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide is 311.08 g/mol.
Where can I buy n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide?
You can request a quote for n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.