![n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide structure](/static/products/1054/105454-04-4.webp)
n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide
TL;DR: n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide (CAS 105454-04-4) is a chemical compound with molecular formula C15H19F6NO4S and molecular weight 423.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide
Also Known As: n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide
| Molecular Formula | C15H19F6NO4S |
|---|---|
| Molecular Weight | 423.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 86.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 7 |
| Exact Mass | 423.0939 |
| Heavy Atoms | 27 |
| Complexity | 569.0 |
Chemical Identifiers
| CAS Number | 105454-04-4 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(CC(C(F)(F)F)(C(F)(F)F)O)O |
| InChIKey | ADEFJCSDMDNELR-UHFFFAOYSA-N |
Product Overview
n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide (CAS 105454-04-4), with molecular formula C15H19F6NO4S and molecular weight 423.09 g/mol. IUPAC: N,N-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide.
Chemical Property Profile of n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide
Property Insights of n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide. The TPSA of 86.2 Ų falls within the moderate polarity range, balancing permeability and solubility for n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide. Following Lipinski's Rule of Five, n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide?
The CAS number of n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide is 105454-04-4.
What is the molecular formula of n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide?
The molecular formula of n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide is C15H19F6NO4S.
What is the molecular weight of n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide?
The molecular weight of n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide is 423.09 g/mol.
Where can I buy n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide?
You can request a quote for n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for n,n-diethyl-3-[4,4,4-trifluoro-1,3-dihydroxy-3-(trifluoromethyl)butyl]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.