F3057-0034
TL;DR: F3057-0034 (CAS 852696-80-1) is a chemical compound with molecular formula C21H15F3N2O4S and molecular weight 448.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-acetylphenyl)-2-[[8-(trifluoromethyl)-[1,3]dioxolo[4,5-g]quinolin-6-yl]sulfanyl]acetamide
Also Known As: F3057-0034, N-(4-ACETYLPHENYL)-2-{[8-(TRIFLUOROMETHYL)-2H-[1,3]DIOXOLO[4,5-G]QUINOLIN-6-YL]SULFANYL}ACETAMIDE, N-(4-acetylphenyl)-2-[[8-(trifluoromethyl)-[1,3]dioxolo[4,5-g]quinolin-6-yl]sulfanyl]acetamide, N-(4-acetylphenyl)-2-{[8-(trifluoromethyl)[1,3]dioxolo[4,5-g]quinolin-6-yl]sulfanyl}acetamide, N-(4-acetylphenyl)-2-((8-(trifluoromethyl)-[1,3]dioxolo[4,5-g]quinolin-6-yl)thio)acetamide
| Molecular Formula | C21H15F3N2O4S |
|---|---|
| Molecular Weight | 448.07 g/mol |
| LogP | 4.9157 |
| Topological Polar Surface Area | 77.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 448.07047 |
| Heavy Atoms | 31 |
| Complexity | 1179.9437 |
Chemical Identifiers
| CAS Number | 852696-80-1 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC4=C(C=C3C(=C2)C(F)(F)F)OCO4 |
Product Overview
F3057-0034 (CAS 852696-80-1), with molecular formula C21H15F3N2O4S and molecular weight 448.07 g/mol. IUPAC: N-(4-acetylphenyl)-2-[[8-(trifluoromethyl)-[1,3]dioxolo[4,5-g]quinolin-6-yl]sulfanyl]acetamide.
Chemical Property Profile of F3057-0034
Property Insights of F3057-0034
The XLogP value of 4.9157 indicates that F3057-0034 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.52 Ų falls within the moderate polarity range, balancing permeability and solubility for F3057-0034. Following Lipinski's Rule of Five, F3057-0034 has 1 hydrogen bond donor(s) and 6 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 F3057-0034?
The CAS number of F3057-0034 is 852696-80-1.
What is the molecular formula of F3057-0034?
The molecular formula of F3057-0034 is C21H15F3N2O4S.
What is the molecular weight of F3057-0034?
The molecular weight of F3057-0034 is 448.07 g/mol.
Where can I buy F3057-0034?
You can request a quote for F3057-0034 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3057-0034?
Yes, KEHONG BIO provides custom synthesis services for F3057-0034 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.