N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide
TL;DR: N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide (CAS 879650-01-8) is a chemical compound with molecular formula C17H11NO5S3 and molecular weight 404.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-oxobenzo[g][1,3]benzoxathiol-5-yl)-N-thiophen-2-ylsulfonylacetamide
Also Known As: N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide, AS-871/42870583, N-(2-oxobenzo[g][1,3]benzoxathiol-5-yl)-N-thiophen-2-ylsulfonylacetamide, N-{2-OXO-2H-NAPHTHO[2,1-D][1,3]OXATHIOL-5-YL}-N-(THIOPHENE-2-SULFONYL)ACETAMIDE
| Molecular Formula | C17H11NO5S3 |
|---|---|
| Molecular Weight | 404.98 g/mol |
| LogP | 3.811 |
| Topological Polar Surface Area | 84.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 404.97995 |
| Heavy Atoms | 26 |
| Complexity | 1299.4318 |
Chemical Identifiers
| CAS Number | 879650-01-8 |
|---|---|
| SMILES | CC(=O)N(C1=CC2=C(C3=CC=CC=C31)OC(=O)S2)S(=O)(=O)C4=CC=CS4 |
Product Overview
N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide (CAS 879650-01-8), with molecular formula C17H11NO5S3 and molecular weight 404.98 g/mol. IUPAC: N-(2-oxobenzo[g][1,3]benzoxathiol-5-yl)-N-thiophen-2-ylsulfonylacetamide.
Chemical Property Profile of N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide
Property Insights of N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide
The XLogP value of 3.811 indicates that N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.66 Ų falls within the moderate polarity range, balancing permeability and solubility for N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide. Following Lipinski's Rule of Five, N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide has 0 hydrogen bond donor(s) and 7 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-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide?
The CAS number of N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide is 879650-01-8.
What is the molecular formula of N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide?
The molecular formula of N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide is C17H11NO5S3.
What is the molecular weight of N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide?
The molecular weight of N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide is 404.98 g/mol.
Where can I buy N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide?
You can request a quote for N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-acetyl-N-(2-oxonaphtho[2,1-d][1,3]oxathiol-5-yl)-2-thiophenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.