![3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione structure](/static/products/125/125287-50-5.webp)
3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione
TL;DR: 3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione (CAS 125287-50-5) is a chemical compound with molecular formula C8H15NO4S2 and molecular weight 253.04425 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-tert-butyl-1,1-dioxo-2,5-dihydrothiophene-3-sulfonamide
Also Known As: 1,1-dioxo-N-tert-butyl-2,5-dihydrothiophene-3-sulfonamide, N-tert-butyl-1,1-dioxo-2,5-dihydrothiophene-3-sulfonamide, N-(tert-butyl)-2,5-dihydrothiophene-3-sulfonamide 1,1-dioxide, 3-{[(tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione
Technical Specifications
| Molecular Formula | C8H15NO4S2 |
| Molecular Weight | 253.04425 g/mol |
| XLogP | -0.5 |
| Topological Polar Surface Area (TPSA) | 97.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.04425 Da |
| Heavy Atoms | 15 |
| Complexity | 468.0 |
| SMILES | CC(C)(C)NS(=O)(=O)C1=CCS(=O)(=O)C1 |
| InChIKey | NLFKCGBYZQZYMS-UHFFFAOYSA-N |
Chemical Property Profile of 3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione
Property Insights of 3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione
The XLogP value of -0.5 indicates that 3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 97.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione. Following Lipinski's Rule of Five, 3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione 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
What is the CAS number of 3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione?
The CAS number of 3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione is 125287-50-5.
What is the molecular formula of 3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione?
The molecular formula of 3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione is C8H15NO4S2.
What is the molecular weight of 3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione?
The molecular weight of 3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione is 253.04425 g/mol.
Where can I buy 3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione?
You can request a quote for 3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione?
Yes, CoreyChem provides custom synthesis services for 3-{[(Tert-butyl)amino]sulfonyl}-2,5-dihydrothiophene-1,1-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.