4-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide
TL;DR: 4-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide (CAS 485829-13-8) is a chemical compound with molecular formula C11H13NO3S2 and molecular weight 271.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-(2-oxothiolan-3-yl)benzenesulfonamide
Also Known As: BAS 00624991, 4-methyl-N-(2-oxothiolan-3-yl)benzenesulfonamide, 4-methyl-N-(2-oxotetrahydro-3-thienyl)benzenesulfonamide, 4-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide, 4-Methyl-N-(2-oxo-tetrahydro-thiophen-3-yl)-benzenesulfonamide
| Molecular Formula | C11H13NO3S2 |
|---|---|
| Molecular Weight | 271.03 g/mol |
| LogP | 1.30542 |
| Topological Polar Surface Area | 63.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.0337 |
| Heavy Atoms | 17 |
| Complexity | 522.15247 |
Chemical Identifiers
| CAS Number | 485829-13-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2CCSC2=O |
Product Overview
4-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide (CAS 485829-13-8), with molecular formula C11H13NO3S2 and molecular weight 271.03 g/mol. IUPAC: 4-methyl-N-(2-oxothiolan-3-yl)benzenesulfonamide.
Chemical Property Profile of 4-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide
Property Insights of 4-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide
The XLogP value of 1.30542 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide. The TPSA of 63.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide. Following Lipinski's Rule of Five, 4-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide has 1 hydrogen bond donor(s) and 4 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-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide?
The CAS number of 4-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide is 485829-13-8.
What is the molecular formula of 4-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide?
The molecular formula of 4-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide is C11H13NO3S2.
What is the molecular weight of 4-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide?
The molecular weight of 4-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide is 271.03 g/mol.
Where can I buy 4-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide?
You can request a quote for 4-methyl-N-(2-oxotetrahydrothiophen-3-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-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.