![5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one structure](/static/products/4390/439096-16-9.webp)
5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one
TL;DR: 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one (CAS 439096-16-9) is a chemical compound with molecular formula C21H21F3N2O3S and molecular weight 438.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[1-(benzenesulfonyl)ethyl]-4-ethyl-3-[[3-(trifluoromethyl)phenyl]methyl]-1H-imidazol-2-one
Also Known As: 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one, 10R-0246, 5-[1-(benzenesulfonyl)ethyl]-4-ethyl-3-[[3-(trifluoromethyl)phenyl]methyl]-1H-imidazol-2-one, 4-[1-(benzenesulfonyl)ethyl]-5-ethyl-1-{[3-(trifluoromethyl)phenyl]methyl}-2,3-dihydro-1H-imidazol-2-one
| Molecular Formula | C21H21F3N2O3S |
|---|---|
| Molecular Weight | 438.12 g/mol |
| LogP | 4.3408 |
| Topological Polar Surface Area | 71.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 438.1225 |
| Heavy Atoms | 30 |
| Complexity | 1196.2249 |
Chemical Identifiers
| CAS Number | 439096-16-9 |
|---|---|
| SMILES | CCC1=C(NC(=O)N1CC2=CC(=CC=C2)C(F)(F)F)C(C)S(=O)(=O)C3=CC=CC=C3 |
Product Overview
5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one (CAS 439096-16-9), with molecular formula C21H21F3N2O3S and molecular weight 438.12 g/mol. IUPAC: 5-[1-(benzenesulfonyl)ethyl]-4-ethyl-3-[[3-(trifluoromethyl)phenyl]methyl]-1H-imidazol-2-one.
Chemical Property Profile of 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one
Property Insights of 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one
The XLogP value of 4.3408 indicates that 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one. Following Lipinski's Rule of Five, 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one has 1 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 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one?
The CAS number of 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one is 439096-16-9.
What is the molecular formula of 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one?
The molecular formula of 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one is C21H21F3N2O3S.
What is the molecular weight of 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one?
The molecular weight of 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one is 438.12 g/mol.
Where can I buy 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one?
You can request a quote for 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-ethyl-4-[1-(phenylsulfonyl)ethyl]-1-[3-(trifluoromethyl)benzyl]-1,3-dihydro-2H-imidazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.