![4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide structure](/static/products/848/848178-44-9.png)
4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide
TL;DR: 4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide (CAS 848178-44-9) is a chemical compound with molecular formula C9H11F3N2O2S and molecular weight 268.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2,2,2-trifluoroethylamino)methyl]benzenesulfonamide
Also Known As: 4-{[(2,2,2-trifluoroethyl)amino]methyl}benzene-1-sulfonamide, 4-[(2,2,2-trifluoroethylamino)methyl]benzenesulfonamide, 4-{[(2,2,2-trifluoroethyl)amino]methyl}benzenesulfonamide, 4-([(2,2,2-Trifluoroethyl)amino]methyl)benzene-1-sulfonamide, 4-{(2,2,2-Trifluoroethyl)aminomethyl}benzene-1-sulfonamide
| Molecular Formula | C9H11F3N2O2S |
|---|---|
| Molecular Weight | 268.05 g/mol |
| LogP | 0.9859 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 268.04935 |
| Heavy Atoms | 17 |
| Complexity | 468.0095 |
Chemical Identifiers
| CAS Number | 848178-44-9 |
|---|---|
| SMILES | C1=CC(=CC=C1CNCC(F)(F)F)S(=O)(=O)N |
Product Overview
4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide (CAS 848178-44-9), with molecular formula C9H11F3N2O2S and molecular weight 268.05 g/mol. IUPAC: 4-[(2,2,2-trifluoroethylamino)methyl]benzenesulfonamide.
Chemical Property Profile of 4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide
Property Insights of 4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide
The XLogP value of 0.9859 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide. Following Lipinski's Rule of Five, 4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide has 2 hydrogen bond donor(s) and 3 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 4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide?
The CAS number of 4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide is 848178-44-9.
What is the molecular formula of 4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide?
The molecular formula of 4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide is C9H11F3N2O2S.
What is the molecular weight of 4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide?
The molecular weight of 4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide is 268.05 g/mol.
Where can I buy 4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide?
You can request a quote for 4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(2,2,2-Trifluoroethyl)amino]methyl}benzene-1-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.