![N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide structure](/static/products/831/831236-57-8.png)
N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide
TL;DR: N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide (CAS 831236-57-8) is a chemical compound with molecular formula C18H21N3O4S2 and molecular weight 407.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide
Also Known As: AP-853/43115860, N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide, N-butyl-4-[(1,1-dioxido-1,2-benzisothiazol-3-yl)amino]-N-methylbenzenesulfonamide, N-butyl-4-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide
| Molecular Formula | C18H21N3O4S2 |
|---|---|
| Molecular Weight | 407.10 g/mol |
| LogP | 2.6682 |
| Topological Polar Surface Area | 95.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 407.09735 |
| Heavy Atoms | 27 |
| Complexity | 1075.8447 |
Chemical Identifiers
| CAS Number | 831236-57-8 |
|---|---|
| SMILES | CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)NC2=NS(=O)(=O)C3=CC=CC=C32 |
Product Overview
N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide (CAS 831236-57-8), with molecular formula C18H21N3O4S2 and molecular weight 407.10 g/mol. IUPAC: N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide.
Chemical Property Profile of N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide
Property Insights of N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide
The XLogP value of 2.6682 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide. The TPSA of 95.91 Ų falls within the moderate polarity range, balancing permeability and solubility for N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide 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
Frequently Asked Questions
What is the CAS number of N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide?
The CAS number of N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide is 831236-57-8.
What is the molecular formula of N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide?
The molecular formula of N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide is C18H21N3O4S2.
What is the molecular weight of N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide?
The molecular weight of N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide is 407.10 g/mol.
Where can I buy N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide?
You can request a quote for N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.