![N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide structure](/static/products/6802/680211-97-6.webp)
N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide
TL;DR: N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide (CAS 680211-97-6) is a chemical compound with molecular formula C12H16N2O4S2 and molecular weight 316.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(furan-2-ylmethylsulfanyl)ethyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
Also Known As: N-(2-((Furan-2-ylmethyl)thio)ethyl)-3,5-dimethylisoxazole-4-sulfonamide, N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide, N-[2-(furan-2-ylmethylsulfanyl)ethyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide, N-[2-[(Fur-2-ylmethyl)thio]ethyl]-3,5-dimethylisoxazole-4-sulphonamide, 3,5-Dimethyl-N-(2-{[(fur-2-yl)methyl]thio}ethyl)isoxazole-4-sulphonamide
| Molecular Formula | C12H16N2O4S2 |
|---|---|
| Molecular Weight | 316.06 g/mol |
| LogP | 2.09614 |
| Topological Polar Surface Area | 85.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 316.05515 |
| Heavy Atoms | 20 |
| Complexity | 627.56024 |
Chemical Identifiers
| CAS Number | 680211-97-6 |
|---|---|
| SMILES | CC1=C(C(=NO1)C)S(=O)(=O)NCCSCC2=CC=CO2 |
Product Overview
N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide (CAS 680211-97-6), with molecular formula C12H16N2O4S2 and molecular weight 316.06 g/mol. IUPAC: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide.
Chemical Property Profile of N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide
Property Insights of N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide
The XLogP value of 2.09614 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide. The TPSA of 85.34 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide. Following Lipinski's Rule of Five, N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide 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-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide?
The CAS number of N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide is 680211-97-6.
What is the molecular formula of N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide?
The molecular formula of N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide is C12H16N2O4S2.
What is the molecular weight of N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide?
The molecular weight of N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide is 316.06 g/mol.
Where can I buy N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide?
You can request a quote for N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide?
Yes, KEHONG BIO provides custom synthesis services for N-{2-[(Fur-2-ylmethyl)thio]ethyl}-3,5-dimethylisoxazole-4-sulphonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.