![4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate structure](/static/products/6631/663168-01-2.webp)
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate
TL;DR: 4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate (CAS 663168-01-2) is a chemical compound with molecular formula C24H23N3O6S2 and molecular weight 513.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]phenyl] 4-(diethylsulfamoyl)benzoate
Also Known As: [4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]phenyl] 4-(diethylsulfamoyl)benzoate|4-((1,1-dioxidobenzo[d]isothiazol-3-yl)amino)phenyl 4-(N,N-diethylsulfamoyl)benzoate|4-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate|4-[(1,1-DIOXO-1H-1,2-BENZISOTHIAZOL-3-YL)AMINO]PHENYL 4-[(DIETHYLAMINO)SULFONYL]BENZOATE
| Molecular Formula | C24H23N3O6S2 |
|---|---|
| Molecular Weight | 513.10 g/mol |
| LogP | 3.4973 |
| Topological Polar Surface Area | 122.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 513.10284 |
| Heavy Atoms | 35 |
| Complexity | 1493.5641 |
Chemical Identifiers
| CAS Number | 663168-01-2 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)NC3=NS(=O)(=O)C4=CC=CC=C43 |
Product Overview
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate (CAS 663168-01-2), with molecular formula C24H23N3O6S2 and molecular weight 513.10 g/mol. IUPAC: [4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]phenyl] 4-(diethylsulfamoyl)benzoate.
Chemical Property Profile of 4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate
Property Insights of 4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate
The XLogP value of 3.4973 indicates that 4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate. Following Lipinski's Rule of Five, 4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate?
The CAS number of 4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate is 663168-01-2.
What is the molecular formula of 4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate?
The molecular formula of 4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate is C24H23N3O6S2.
What is the molecular weight of 4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate?
The molecular weight of 4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate is 513.10 g/mol.
Where can I buy 4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate?
You can request a quote for 4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.